Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL283604 | 0.82 | ALDH1A1 (0.55) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL14397632 | 0.82 | ALDH1A1 (0.55) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL28168533 | 0.82 | ALDH1A1 (0.53) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL1129712 | 0.81 | ALDH1A1 (0.64) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL19859435 | 0.80 | ALDH1A1 (0.54) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL680532 | 0.79 | ALDH1A1 (0.65) | ALDH1A1GLATP53TSHRHIF1A | |
| Ammonia Solution, Strong SCHEMBL10520162 | 0.79 | ALDH1A1 (0.53) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL10695774 | 0.78 | ALDH1A1 (0.56) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL729501 | 0.76 | ALDH1A1 (0.65) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL29168006 | 0.75 | ALDH1A1 (0.56) | ALDH1A1GLATP53TSHRHIF1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070135607-A1 | TDI prepolymers with improved processing characteristics | ROSTHAUSER JAMES W | 2007-06-14 | — | — | US | disclosed |
| US-7030274-B2 | Process for the production of carbodiimide modified organic isocyanates | BAYER MATERIALSCIENCE LLC (US) | 2006-04-18 | — | — | US | disclosed |
| US-20050282989-A1 | TDI prepolymers with improved processing characteristics | BAYER MATERIALSCIENCE LLC | 2005-12-22 | — | — | US | disclosed |
| US-20050282993-A1 | Process for the production of carbodiimide modified organic isocyanates | COVESTRO LLC | 2005-12-22 | — | — | US | disclosed |
| EP-1607425-A1 | Process for the production of carboiimide modified organic isocyanates | Bayer MaterialScience LLC (US) | 2005-12-21 | — | — | EP | disclosed |
| US-6528609-B1 | Reacting polymethylene polyphenylisocyanate with epoxide along with alcohol, converted to allophanate upon addition of a metal divalent catalyst; storage stability; mild conditions and low catalyst levels | BAYER CORPORATION | 2003-03-04 | — | — | US | disclosed |
| US-5837794-A | REACTION OF DIAMINE WITH PHOSGENE TO FORM TOLUENE DIISOCYANATE THEN REACTION WITH ALCOHOL TO FORM URETHANE OR POLYURETHANE | BAYER CORPORATION (US) | 1998-11-17 | — | — | US | disclosed |
| EP-0844276-A1 | Reactivity stabilization of polymethylene poly(phenylisocyanates) | Bayer Corporation (US) | 1998-05-27 | — | — | EP | disclosed |
| US-5726240-A | MIXTURE WITH EPOXIDIZED GLYCERIDES AND/OR DIMER AND/OR TRIMER FATTY ACIDS; DISCOLORATION INHIBITION | BAYER CORPORATION (US) | 1998-03-10 | — | — | US | disclosed |
| EP-0631532-B1 | THERMOSETTING BINDER FOR AN ABRASIVE ARTICLE | MINNESOTA MINING & MFG (US) | 1996-05-22 | — | — | EP | disclosed |
| US-5451446-A | Polyepoxides | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-09-19 | — | — | US | disclosed |
| EP-0631532-A1 | THERMOSETTING BINDER FOR AN ABRASIVE ARTICLE. | MINNESOTA MINING & MFG (US) | 1995-01-04 | — | — | EP | disclosed |
| WO-1993017832-A1 | THERMOSETTING BINDER FOR AN ABRASIVE ARTICLE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-09-16 | — | — | WO | disclosed |