Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9855389 | 1.00 | KMT2A (0.37) | KMT2AHSD11B1HTR2AHTR2CHTR7 | |
| SCHEMBL9855321 | 0.92 | RAB9A (0.41) | KMT2AHSD11B1NPC1RAB9A | |
| SCHEMBL9855322 | 0.92 | RAB9A (0.41) | KMT2AHSD11B1NPC1RAB9A | |
| SCHEMBL9855365 | 0.83 | KMT2A (0.41) | KMT2AHSD11B1HTR2AHTR2CHTR7 | |
| SCHEMBL9855369 | 0.75 | RAB9A (0.45) | KMT2AHSD11B1NPC1RAB9A | |
| SCHEMBL9855210 | 0.73 | CYP1A2 (0.40) | HTR7CES2CES1TNFRSF1ACYP1A2 | |
| SCHEMBL9855216 | 0.73 | CYP1A2 (0.40) | HTR7CES2CES1TNFRSF1ACYP1A2 | |
| SCHEMBL9855471 | 0.72 | HTR7 (0.38) | HTR7CES2CES1TNFRSF1ANPC1 | |
| SCHEMBL9855475 | 0.72 | HTR7 (0.38) | HTR7CES2CES1TNFRSF1ANPC1 | |
| SCHEMBL9859522 | 0.69 | ALDH1A1 (0.39) | KMT2ACES2CES1NPC1RAB9A |
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-5011947-A | Enzyme inhibitors for cholesterol biosythesis | BRISTOL-MYERS (US) | 1991-04-30 | — | — | US | disclosed |