Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 10/20 | 0.48 |
| ▸ | DRD3 | P35462 | 10/20 | 0.48 |
| ▸ | DRD4 | P21917 | 4/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | DRD5 | P21918 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8410457 | 0.87 | CA1 (0.52) | CYP19A1DRD2DRD3DRD4HTR1A | |
| SCHEMBL8413532 | 0.81 | CYP19A1 (0.57) | CYP19A1DRD2DRD3DRD4HTR1A | |
| SCHEMBL8326776 | 0.80 | DRD2 (0.51) | DRD2DRD3DRD4DRD1DRD5 | |
| SCHEMBL12798477 | 0.77 | ESR1 (0.51) | DRD2HTR1ACA1CA2 | |
| SCHEMBL2246761 | 0.77 | GAA (0.47) | — | |
| SCHEMBL29062621 | 0.76 | DRD2 (0.59) | CYP19A1DRD2DRD3DRD4HTR1A | |
| SCHEMBL29062570 | 0.76 | DRD2 (0.59) | CYP19A1DRD2DRD3DRD4HTR1A | |
| SCHEMBL9005649 | 0.76 | PTGIR (0.54) | — | |
| SCHEMBL23856684 | 0.76 | NLRP3 (0.43) | — | |
| SCHEMBL11471209 | 0.76 | CHRM3 (0.49) | DRD2DRD3HTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0869787-A4 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 1999-03-24 | — | — | EP | disclosed |
| EP-0869787-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-10-14 | — | — | EP | disclosed |
| WO-1997024119-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-07-10 | — | — | WO | disclosed |