Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL8619292 | 0.85 | GPBAR1 (0.34) | HSD17B10FKBP1A | |
| SCHEMBL8621103 | 0.85 | ACE (0.34) | ITGB3ITGA2BCYP19A1FKBP1ACHRM3 | |
| SCHEMBL8617240 | 0.84 | ITGB3 (0.39) | ITGB3ITGA2BHSD17B10MEN1KMT2A | |
| SCHEMBL8619325 | 0.84 | MC4R (0.38) | ITGB3ITGA2BCYP19A1MEN1KMT2A | |
| SCHEMBL7322436 | 0.83 | HRH3 (0.40) | ITGB3ITGA2BHRH3CYP19A1GFER | |
| SCHEMBL8619314 | 0.82 | MTNR1A (0.40) | ITGB3ITGA2BCYP19A1MEN1KMT2A | |
| SCHEMBL8621090 | 0.82 | MTNR1A (0.36) | ITGB3ITGA2BHSD17B10CYP19A1CHRM3 | |
| SCHEMBL8617159 | 0.82 | DPP4 (0.37) | ITGB3ITGA2BROCK1 | |
| SCHEMBL8619355 | 0.80 | ITGB3 (0.39) | ITGB3ITGA2BHRH3FAAHCYP19A1 | |
| SCHEMBL8915843 | 0.78 | ITGB3 (0.33) | ITGB3ITGA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5852045-A | Fibrinogen receptor antagonists | MERCK & CO., INC. (US) | 1998-12-22 | — | — | US | disclosed |
| US-5773575-A | REACTING A CARBOXYLIC ACID AND AMINE WITH COUPLING AGENT | MERCK & CO., INC. (US) | 1998-06-30 | — | — | US | disclosed |
| US-5502165-A | AMIDATION OF CARBOXY COMPOOUND WITH AMINE IN WATER AND SOLVENT | MERCK & CO., INC. (US) | 1996-03-26 | — | — | US | disclosed |