Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2537216 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| Acetic Acid SCHEMBL28803626 | 0.78 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| Acetic Acid SCHEMBL2896489 | 0.78 | ALDH1A1 (0.55) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL28018504 | 0.78 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL15963 | 0.78 | ALDH1A1 (0.61) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL28170047 | 0.78 | ALDH1A1 (0.61) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL472709 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL472712 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL6137551 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1HSD17B10THRB | |
| SCHEMBL6137545 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1HSD17B10THRB |
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-20070104962-A1 | Hydrophillic polyisocyanate mixtures | BAYER MATERIALSCIENCE AG | 2007-05-10 | — | — | US | disclosed |
| US-6777523-B1 | POLYETHER-MODIFIED, WATER-DISPERSIBLE POLYISOCYANATE MIXTURES, AS INITIAL COMPONENT IN THE PRODUCTION OF POLYURETHANE PLASTICS, IN PARTICULAR AS CROSSLINKER FOR WATER- SOLUBLE OR WATER-DISPERSIBLE LACQUER BINDING AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2004-08-17 | — | — | US | disclosed |
| US-6767958-B2 | REACTED WITH 2- (CYCLOHEXYLAMINO)-ETHANESULFONIC ACID AND/OR 3-(CYCLOHEXYLAMINO) -ETHANESULFONIC ACID AND/OR 3-(CYCLOHEXYLAMINO) -PROPANESULFONIC ACID; COATINGS | BAYER AKTIENGESELLSCHAFT (DE) | 2004-07-27 | — | — | US | disclosed |
| US-20040034162-A1 | Modified polyisocyanates | COVESTRO DEUTSCHLAND AG (DE) | 2004-02-19 | — | — | US | disclosed |
| US-6426414-B1 | REACTING DIISOCYANATOHEXANE WITH POLYOXYETHYLENE GLYCOL FORMING COMPOUNDS/POLYMERS CONTAINING POLYISOCYANURATE GROUPS; FOR USE AS STARTING COMPONENTS IN POLYURETHANE PLASTICS AND CROSSLINKING AGENTS FOR AQUEOUS BINDER COMPOSITIONS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-07-30 | — | — | US | disclosed |