Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 7/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | NR3C1 | P04150 | 7/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.59 |
| ▸ | PGR | P06401 | 4/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.59 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | AR | P10275 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | APEX1 | P27695 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL11056197 | 1.00 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL11063014 | 1.00 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL11056193 | 1.00 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL11058350 | 1.00 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL9569096 | 0.90 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL9569095 | 0.90 | HIF1A (0.61) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL10702804 | 0.86 | HIF1A (0.58) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL11061414 | 0.86 | HIF1A (0.60) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL11061420 | 0.86 | HIF1A (0.60) | HIF1ACYP3A4LMNAALDH1A1NR3C1 | |
| SCHEMBL10702799 | 0.86 | HIF1A (0.58) | HIF1ACYP3A4LMNAALDH1A1NR3C1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4481144-A | 17-Substituted thia-17-alkyl(or alkenyl or alkynyl)androstenes | E. R. SQUIBB & SONS, INC. (US) | 1984-11-06 | — | — | US | claimed |
| US-4481144-A | 17-Substituted thia-17-alkyl(or alkenyl or alkynyl)androstenes | E. R. SQUIBB & SONS, INC. (US) | 1984-11-06 | — | — | US | disclosed |