Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 15/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SHBG | P04278 | 3/20 | 0.42 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.42 |
| ▸ | SNCA | P37840 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10596334 | 1.00 | CYP19A1 (0.60) | CYP19A1SMN1; SMN2LMNAPOLBALDH1A1 | |
| SCHEMBL10945246 | 1.00 | CYP19A1 (0.60) | CYP19A1SMN1; SMN2LMNAPOLBALDH1A1 | |
| SCHEMBL6833918 | 0.84 | CYP19A1 (0.67) | CYP19A1SMN1; SMN2LMNAPOLBALDH1A1 | |
| SCHEMBL10595811 | 0.84 | CYP19A1 (0.46) | CYP19A1LMNAPOLBALDH1A1SHBG | |
| SCHEMBL10595790 | 0.84 | CYP19A1 (0.46) | CYP19A1LMNAPOLBALDH1A1SHBG | |
| SCHEMBL10947056 | 0.83 | CYP19A1 (0.43) | CYP19A1LMNAALDH1A1 | |
| SCHEMBL10947066 | 0.83 | CYP19A1 (0.43) | CYP19A1LMNAALDH1A1 | |
| SCHEMBL9547847 | 0.82 | CYP19A1 (0.64) | CYP19A1SMN1; SMN2LMNAPOLBALDH1A1 | |
| SCHEMBL10948537 | 0.82 | CYP19A1 (0.46) | CYP19A1SHBG | |
| SCHEMBL10946739 | 0.82 | CYP19A1 (0.46) | CYP19A1SHBG |
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-4557867-A | CONTRACEPTIVES | THE UPJOHN COMPANY (US) | 1985-12-10 | — | — | US | claimed |
| EP-0145493-B1 | 11-DIFLUOROMETHYL AND 11-FLUOROMETHYLENE STEROIDS | THE UPJOHN COMPANY (US) | 1989-03-08 | — | — | EP | disclosed |
| US-4557867-A | CONTRACEPTIVES | THE UPJOHN COMPANY (US) | 1985-12-10 | — | — | US | disclosed |
| EP-0145493-A2 | 11-Difluoromethyl and 11-fluoromethylene steroids | THE UPJOHN COMPANY (US) | 1985-06-19 | — | — | EP | disclosed |