Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.38 |
| ▸ | GRK5 | P34947 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL587423 | 0.86 | TACR1 (0.45) | TACR1NOTUMCETPS1PR1S1PR5 | |
| SCHEMBL581052 | 0.86 | POLB (0.43) | TSHRKMT2AALDH1A1SMN1; SMN2SIGMAR1 | |
| SCHEMBL581020 | 0.85 | OPRK1 (0.35) | TACR1CETPKMT2AALDH1A1MAPT | |
| SCHEMBL3075266 | 0.85 | TACR1 (0.50) | TACR1NOTUMS1PR1S1PR5GRK5 | |
| SCHEMBL582159 | 0.84 | OPRK1 (0.36) | TACR1KMT2AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL586714 | 0.82 | TACR1 (0.46) | TACR1CETPTSHRKMT2AALDH1A1 | |
| SCHEMBL581110 | 0.82 | TACR1 (0.48) | TACR1NOTUMS1PR1S1PR5GRK5 | |
| SCHEMBL581990 | 0.75 | CYP3A4 (0.43) | KMT2AMAPT | |
| SCHEMBL587559 | 0.75 | TACR1 (0.43) | TACR1NOTUMKMT2AALDH1A1MAPT | |
| SCHEMBL580899 | 0.74 | PLG (0.48) | ALDH1A1MAPTHPGDNPSR1HSD17B10 |
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 |