Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 18/20 | 0.71 |
| ▸ | CYP11B2 | P19099 | 18/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.71 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.68 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.68 |
| ▸ | BMPR1B | O00238 | 2/20 | 0.57 |
| ▸ | BMPR1A | P36894 | 2/20 | 0.57 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.57 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.57 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL744757 | 0.88 | ACVRL1 (0.69) | CYP11B1CYP11B2CYP1A2BMPR1BBMPR1A | |
| SCHEMBL14816646 | 0.85 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL14778946 | 0.85 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL31260114 | 0.85 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| Hydrochloric Acid SCHEMBL14778746 | 0.84 | CYP11B1 (0.68) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL1119367 | 0.83 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL16574003 | 0.83 | CYP11B1 (0.62) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL14779569 | 0.82 | CYP11B1 (0.68) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL21535285 | 0.82 | CYP11B1 (0.65) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 | |
| SCHEMBL14779462 | 0.82 | CYP11B1 (0.65) | CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2755963-B1 | NEW DIHYDROQUINOLINE-2-ONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2019-10-30 | — | — | EP | disclosed |