Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.43 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5608451 | 0.89 | CYP19A1 (0.59) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL15700140 | 0.80 | ACHE (0.56) | CYP19A1HTR1ASIGMAR1ACHEHTR2C | |
| SCHEMBL8535642 | 0.79 | CYP19A1 (0.58) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL6631961 | 0.77 | MTNR1A (0.60) | CYP19A1ALDH1A1MAPTSMN1; SMN2TP53 | |
| SCHEMBL11734950 | 0.77 | CYP19A1 (0.59) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL7672871 | 0.77 | CYP19A1 (0.57) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL6630621 | 0.76 | METAP1 (0.51) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL11842381 | 0.75 | CYP19A1 (0.55) | CYP19A1HTR1ASIGMAR1ACHEALDH1A1 | |
| SCHEMBL3761876 | 0.75 | CYP19A1 (0.80) | CYP19A1HTR1ASIGMAR1ACHECYP26A1 | |
| SCHEMBL28733987 | 0.75 | CYP19A1 (0.80) | CYP19A1HTR1ASIGMAR1ACHECYP26A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4732898-A | HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1988-03-22 | — | — | US | disclosed |