Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | APLNR | P35414 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 6/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL5301039 | 0.80 | APLNR (0.42) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL3252218 | 0.78 | CA1 (0.43) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL1620621 | 0.75 | HDAC3 (0.46) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL2087588 | 0.74 | TDP1 (0.52) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL2776487 | 0.74 | APLNR (0.46) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL1885244 | 0.74 | TDP1 (0.47) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL4569621 | 0.74 | MEN1 (0.45) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL15134348 | 0.73 | APLNR (0.42) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL4083189 | 0.73 | APLNR (0.42) | MEN1GAAKMT2AAPLNRTDP1 | |
| SCHEMBL7192070 | 0.72 | TDP1 (0.50) | APLNRTDP1CA1CA12CA2 |
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-2018089357-A1 | INDAZOLE DERIVATIVES AS αV INTEGRIN ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |