Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 7/20 | 0.52 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.52 |
| ▸ | PGR | P06401 | 4/20 | 0.52 |
| ▸ | AR | P10275 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SHBG | P04278 | 3/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.52 |
| ▸ | HRH2 | P25021 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11245421 | 1.00 | CYP17A1 (0.61) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL9622429 | 0.88 | LMNA (0.67) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL13941337 | 0.88 | LMNA (0.67) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL853001 | 0.88 | LMNA (0.67) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL11236389 | 0.85 | CYP3A4 (0.59) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL11236392 | 0.85 | CYP3A4 (0.59) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL29356176 | 0.85 | LMNA (0.70) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL10900154 | 0.85 | LMNA (0.70) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL10900163 | 0.85 | LMNA (0.70) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 | |
| SCHEMBL11205510 | 0.84 | LMNA (0.55) | CYP17A1LMNANR3C1SMN1; SMN2CYP3A4 |
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-4322349-A | Process for preparing 6-methylene steroids | SCHERING AKTIENGESELLSCHAFT (DE) | 1982-03-30 | — | — | US | disclosed |