Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | QDPR | P09417 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | KHK | P50053 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10988298 | 0.80 | SIGMAR1 (0.53) | ALDH1A1HTR2CSIGMAR1QDPRMEN1 | |
| SCHEMBL2422050 | 0.79 | SIGMAR1 (0.50) | ALDH1A1HTR2CSIGMAR1 | |
| SCHEMBL9913555 | 0.78 | ALDH1A1 (0.56) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| SCHEMBL3458436 | 0.67 | RXRA (0.39) | CYP3A4TDP1ALDH1A1TP53HTR2C | |
| SCHEMBL7795551 | 0.66 | ALDH1A1 (0.53) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| SCHEMBL10669275 | 0.61 | CYP3A4 (0.46) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| SCHEMBL258287 | 0.60 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| Benzidine SCHEMBL720393 | 0.60 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| SCHEMBL2024128 | 0.60 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1TP53TAAR1 | |
| Benzidine SCHEMBL29021 | 0.60 | CYP3A4 (1.00) | CYP3A4TDP1ALDH1A1TP53TAAR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2699572-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | Origenis GmbH (DE) | 2014-02-26 | — | — | EP | disclosed |
| EP-2699579-A1 | PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS | Origenis GmbH (DE) | 2014-02-26 | — | — | EP | disclosed |
| CN-103492389-A | Pyrazolo [4, 3-d] pyrimidines useful as kinase inhibitors | ORIGENIS GMBH | 2014-01-01 | — | — | CN | disclosed |
| WO-2012143143-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | ORIGENIS GMBH (DE) | 2012-10-26 | — | — | WO | disclosed |
| WO-2012143144-A1 | PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS | ORIGENIS GMBH (DE) | 2012-10-26 | — | — | WO | disclosed |