Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 7/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5309109 | 0.83 | CYP19A1 (0.41) | CYP19A1DDB1CRBN | |
| SCHEMBL7058755 | 0.80 | DDB1 (0.42) | DDB1CRBN | |
| Hydrochloric Acid SCHEMBL31029179 | 0.77 | CYP19A1 (0.40) | CYP19A1DDB1CRBN | |
| SCHEMBL6958220 | 0.75 | P2RX7 (0.40) | — | |
| SCHEMBL6619946 | 0.73 | PTGS2 (0.41) | — | |
| SCHEMBL30912484 | 0.71 | KDM4E (0.54) | CYP19A1DDB1CRBN | |
| SCHEMBL30912593 | 0.71 | KDM4E (0.54) | CYP19A1DDB1CRBN | |
| SCHEMBL30912576 | 0.71 | KDM4E (0.54) | CYP19A1DDB1CRBN | |
| SCHEMBL26548245 | 0.69 | CYP19A1 (0.45) | CYP19A1 | |
| SCHEMBL19694652 | 0.67 | HTR2C (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3066098-A1 | SUBSTITUTED URACILS AND USE THEREOF | Bayer Pharma Aktiengesellschaft (DE) | 2016-09-14 | — | — | EP | disclosed |
| WO-2015067630-A1 | SUBSTITUTED URACILS AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-05-14 | — | — | WO | disclosed |
| EP-1326865-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002030930-A2 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2002-04-18 | — | — | WO | disclosed |