Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 10/20 | 0.61 |
| ▸ | LMNA | P02545 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.58 |
| ▸ | NR3C2 | P08235 | 5/20 | 0.58 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | PGR | P06401 | 3/20 | 0.58 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | SHBG | P04278 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.54 |
| ▸ | HSD11B2 | P80365 | 2/20 | 0.54 |
| ▸ | AR | P10275 | 2/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL16387349 | 1.00 | HIF1A (0.61) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL16387355 | 0.87 | HIF1A (0.57) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL17591544 | 0.87 | HIF1A (0.57) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL16387364 | 0.87 | HIF1A (0.57) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL17634428 | 0.85 | HIF1A (0.54) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL16389277 | 0.85 | HIF1A (0.54) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL16387356 | 0.85 | HIF1A (0.54) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL16387366 | 0.85 | HIF1A (0.54) | HIF1ALMNASMN1; SMN2NR3C2NR3C1 | |
| SCHEMBL10868441 | 0.84 | SHBG (0.70) | HIF1ALMNASMN1; SMN2NR3C1CYP2C19 | |
| SCHEMBL10892430 | 0.84 | SHBG (0.70) | HIF1ALMNASMN1; SMN2NR3C1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2794632-B1 | PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS | CRYSTAL PHARMA SAU (ES) | 2016-03-16 | — | — | EP | disclosed |
| WO-2013092668-A1 | PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS | CRYSTAL PHARMA, S.A.U. (ES) | 2013-06-27 | — | — | WO | disclosed |