Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 7/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL581783 | 0.96 | TACR1 (0.46) | TACR1NOTUMCYP3A4MAPTMAPK1 | |
| SCHEMBL581282 | 0.96 | TACR1 (0.46) | TACR1NOTUMCYP3A4MAPTMAPK1 | |
| SCHEMBL581526 | 0.96 | TACR1 (0.46) | TACR1NOTUMCYP3A4MAPTMAPK1 | |
| SCHEMBL586823 | 0.96 | TACR1 (0.44) | TACR1CYP3A4MAPTMAPK1OPRK1 | |
| SCHEMBL581527 | 0.96 | TACR1 (0.46) | TACR1NOTUMCYP3A4MAPTMAPK1 | |
| SCHEMBL587423 | 0.88 | TACR1 (0.45) | TACR1NOTUMMAPTKMT2AALDH1A1 | |
| SCHEMBL581238 | 0.86 | NPC1 (0.41) | TACR1CYP3A4MAPK1KDM4EKMT2A | |
| SCHEMBL588023 | 0.84 | OPRK1 (0.45) | CYP3A4MAPTOPRK1KMT2AALDH1A1 | |
| SCHEMBL580834 | 0.84 | NOTUM (0.41) | NOTUMCYP3A4MAPTKMT2AALDH1A1 | |
| SCHEMBL586614 | 0.84 | ALDH1A1 (0.43) | MAPTOPRK1KMT2AALDH1A1HPGD |
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-2417131-A1 | ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS | AstraZeneca AB (SE) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010117323-A1 | METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE | ASTRAZENECA AB (SE) | 2010-10-14 | — | — | WO | disclosed |