Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.50 |
| ▸ | GRM5 | P41594 | 2/20 | 0.47 |
| ▸ | SRD5A1 | P18405 | 4/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8283186 | 0.84 | CASP1 (0.50) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL29431442 | 0.83 | SRD5A2 (0.66) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL1275273 | 0.83 | SRD5A2 (0.66) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL10518407 | 0.81 | CASP1 (0.52) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL1091518 | 0.78 | CASP1 (0.56) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL9944563 | 0.78 | CASP1 (0.52) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL8253223 | 0.78 | NPC1 (0.61) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL8254416 | 0.75 | CASP1 (0.49) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL4424918 | 0.74 | HSD17B1 (0.68) | CASP1CASP7HSD17B10HSD17B1GRM5 | |
| SCHEMBL31532073 | 0.74 | SRD5A1 (0.51) | CASP1CASP7HSD17B10HSD17B1SRD5A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006128184-A2 | PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS | ALANTOS-PHARMACEUTICALS, INC. (US) | 2006-11-30 | — | — | WO | disclosed |