Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | KDM4A | O75164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11614140 | 0.83 | ALDH1A1 (0.45) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL8172816 | 0.83 | ALDH1A1 (0.45) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7747516 | 0.78 | — | — | |
| SCHEMBL14817327 | 0.76 | ALDH1A1 (0.41) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL20375140 | 0.74 | ALDH1A1 (0.39) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL11690421 | 0.74 | ALDH1A1 (0.39) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL11690424 | 0.74 | ALDH1A1 (0.39) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL24785862 | 0.74 | — | — | |
| SCHEMBL3360045 | 0.74 | ALDH1A1 (0.41) | ALDH1A1GAACHRNB2CHRNA4KMT2A | |
| SCHEMBL10014036 | 0.73 | NQO1 (0.35) | ALDH1A1KMT2AMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10752728-B2 | TDI based low-viscosity polyisocyanates with isocyanurate groups | COVESTRO DEUTSCHLAND AG (DE) | 2020-08-25 | — | — | US | disclosed |
| US-10730997-B2 | TDI based polyisocyanate mixture with a high solids content | COVESTRO DEUTSCHLAND AG (DE) | 2020-08-04 | — | — | US | disclosed |
| US-20190270842-A1 | TDI BASED LOW-VISCOSITY POLYISOCYANATES WITH ISOCYANURATE GROUPS | COVESTRO DEUTSCHLAND AG (DE) | 2019-09-05 | — | — | US | disclosed |
| US-20190270843-A1 | TDI BASED POLYISOCYANATE MIXTURE WITH A HIGH SOLIDS CONTENT | COVESTRO DEUTSCHLAND AG (DE) | 2019-09-05 | — | — | US | disclosed |
| US-20180079852-A1 | POLYISOCYANATE COMPOSITION BASED ON 1,5-PENTAMETHYLENE DIISOCYANATE | COVESTRO DEUTSCHLAND (DE) | 2018-03-22 | — | — | US | disclosed |