Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.52 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.52 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.52 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.52 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9383785 | 0.83 | KDM4E (0.56) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 | |
| SCHEMBL26253632 | 0.80 | KDM4E (0.52) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 | |
| SCHEMBL12777946 | 0.78 | ALDH1A1 (0.51) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 | |
| SCHEMBL6697417 | 0.78 | ALDH1A1 (0.66) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 | |
| Benzene SCHEMBL27781609 | 0.75 | KMT2A (0.47) | ALDH1A1KMO | |
| SCHEMBL28825532 | 0.74 | CYP1A2 (0.49) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 | |
| SCHEMBL13733343 | 0.73 | KCNH2 (0.39) | KDM1A | |
| SCHEMBL29678302 | 0.73 | TSHR (0.58) | ALDH1A1IDO1CTSSKDM1AMAOB | |
| SCHEMBL1263144 | 0.73 | TSHR (0.58) | ALDH1A1IDO1CTSSKDM1AMAOB | |
| SCHEMBL10850137 | 0.73 | KDR (0.59) | ALDH1A1KDM4ECYP1A2CYP3A4GABRA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2699579-A1 | PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS | Origenis GmbH (DE) | 2014-02-26 | — | — | EP | claimed |
| WO-2012143144-A1 | PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS | ORIGENIS GMBH (DE) | 2012-10-26 | — | — | WO | claimed |