Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 4/20 | 0.42 |
| ▸ | CASP6 | P55212 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27513674 | 0.84 | CA2 (0.40) | ALDH1A1HSD17B10CA2MAPTTDP1 | |
| SCHEMBL27535845 | 0.84 | CA2 (0.51) | ALDH1A1HSD17B10CYP2C9CYP2C19LMNA | |
| SCHEMBL9818493 | 0.80 | MAOB (0.61) | ALDH1A1MAOAMAOBLMNAHPGD | |
| SCHEMBL27602799 | 0.80 | TAS2R14 (0.55) | ALDH1A1LMNACA2MAPTTHRB | |
| SCHEMBL28956253 | 0.76 | MEN1 (0.56) | LMNAMAPTTHRB | |
| SCHEMBL11789445 | 0.76 | VCP (0.44) | ALDH1A1HSD17B10MAOAMAOBPTPN11 | |
| SCHEMBL1159769 | 0.76 | PDGFRB (0.44) | ALDH1A1HSD17B10MAOAMAOBCASP6 | |
| SCHEMBL2315116 | 0.76 | HTR6 (0.43) | ALDH1A1HSD17B10MAOAMAOBPTPN11 | |
| SCHEMBL12863079 | 0.76 | MAOA (0.45) | ALDH1A1HSD17B10MAOAMAOBCASP6 | |
| SCHEMBL27512967 | 0.76 | MAPT (0.40) | ALDH1A1CA2MAPTTHRBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-1129941-A | Substituted azaindolylidene compounds and process for their preparation | PHARMACIA SPA (IT) | 1996-08-28 | — | — | CN | disclosed |