Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 8/20 | 0.66 |
| ▸ | PGR | P06401 | 8/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.66 |
| ▸ | LMNA | P02545 | 4/20 | 0.66 |
| ▸ | ABCB11 | O95342 | 4/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.66 |
| ▸ | ESR1 | P03372 | 3/20 | 0.66 |
| ▸ | SHBG | P04278 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.66 |
| ▸ | AR | P10275 | 7/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10945949 | 0.90 | NR3C1 (0.54) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL10945872 | 0.86 | PGR (0.55) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL11424896 | 0.86 | PGR (0.70) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL11783966 | 0.86 | PGR (0.70) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL10945250 | 0.86 | PGR (0.52) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL11432256 | 0.85 | PGR (0.69) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL7949838 | 0.85 | NR3C1 (0.69) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL10598724 | 0.84 | PGR (0.70) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL7948023 | 0.84 | PGR (0.64) | NR3C1PGRCYP3A4LMNAABCB11 | |
| SCHEMBL10949417 | 0.83 | PGR (0.65) | NR3C1PGRCYP3A4LMNAABCB11 |
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 3 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 |
| 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 |