Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.57 |
| ▸ | HTR2B | P41595 | 1/20 | 0.57 |
| ▸ | CTSC | P53634 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MASP2 | O00187 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | PREP | P48147 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8130551 | 1.00 | HTR2C (0.57) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL9115117 | 1.00 | HTR2C (0.57) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL8773337 | 1.00 | HTR2C (0.57) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL8773325 | 1.00 | HTR2C (0.57) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL8130548 | 1.00 | HTR2C (0.57) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL14131110 | 0.96 | HTR2C (0.54) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL5095147 | 0.95 | HTR2C (0.53) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL10934562 | 0.88 | CTSC (0.55) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL28346532 | 0.88 | CTSC (0.55) | HTR2CHTR2BCTSCCYP3A4CYP2D6 | |
| SCHEMBL27343494 | 0.88 | CTSC (0.55) | HTR2CHTR2BCTSCCYP3A4CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5674905-A | ADMINISTERING AS GASTRIN OR CHOLECYSTOKININ ANTAGONISTS | JAMES BLACK FOUNDATION LIMITED (GB) | 1997-10-07 | — | — | US | disclosed |
| EP-0655053-B1 | BICYCLOOCTANE AND BICYCLOHEPTANE DERIVATIVES | BLACK JAMES FOUNDATION (GB) | 1997-09-03 | — | — | EP | disclosed |
| EP-0655053-A1 | BICYCLOOCTANE AND BICYCLOHEPTANE DERIVATIVES. | BLACK JAMES FOUNDATION (GB) | 1995-05-31 | — | — | EP | disclosed |
| WO-1994000421-A1 | BICYCLOOCTANE AND BICYCLOHEPTANE DERIVATIVES | JAMES BLACK FOUNDATION LIMITED (GB) | 1994-01-06 | — | — | WO | disclosed |