Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K8 | P41279 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.34 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2076283 | 0.73 | ALDH1A1 (0.44) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL30986042 | 0.73 | ALDH1A1 (0.44) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL12497307 | 0.73 | EGFR (0.51) | GRM5ALDH1A1GAACYP3A4 | |
| SCHEMBL27885731 | 0.71 | DHFR (0.40) | MAP3K8GRM5KCNA5CYP3A4MEN1 | |
| SCHEMBL3409401 | 0.71 | KCNA5 (0.49) | GRM5ALDH1A1KCNA5CYP3A4 | |
| SCHEMBL9255842 | 0.71 | CYP3A4 (0.46) | GRM5ALDH1A1GAAKCNA5CYP3A4 | |
| Hydrochloric Acid SCHEMBL4024971 | 0.69 | KCNA5 (0.47) | GRM5ALDH1A1KCNA5CYP3A4KCNN4 | |
| SCHEMBL13367400 | 0.69 | DHFR (0.49) | KDM4EALDH1A1SMN1; SMN2HPGDGLA | |
| SCHEMBL2073157 | 0.69 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2GAAHPGD | |
| SCHEMBL18783028 | 0.67 | CHRNB2 (0.41) | GRM5ALDH1A1GAAKCNA5CYP3A4 |
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-7863444-B2 | 4-aminopyrrolopyrimidines as kinase inhibitors | ABBOTT LABORATORIES (US) | 2011-01-04 | — | — | US | disclosed |