Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Nitrobenzene SCHEMBL27619171 | 0.88 | ALDH1A1 (0.53) | MAPK1POLBLMNAGAACES2 | |
| SCHEMBL28090568 | 0.88 | TSHR (0.55) | MAPK1POLBCES2CES1TSHR | |
| SCHEMBL28203340 | 0.86 | ALDH1A1 (0.47) | MAPK1POLBLMNAGAACES2 | |
| Methyl Carbamate SCHEMBL28103654 | 0.85 | POLB (0.64) | MAPK1POLBLMNAGAASRD5A2 | |
| SCHEMBL27587947 | 0.84 | MAPK1 (0.62) | MAPK1POLBLMNAGAASRD5A2 | |
| Acetamide SCHEMBL28079768 | 0.84 | MAPK1 (0.70) | MAPK1POLBLMNAGAASRD5A2 | |
| Carbamic Acid SCHEMBL27688398 | 0.83 | MAPK1 (0.74) | MAPK1POLBLMNAGAASRD5A2 | |
| Urea SCHEMBL27562006 | 0.83 | MAPK1 (0.74) | MAPK1POLBLMNAGAASRD5A2 | |
| Chloromethane SCHEMBL28092918 | 0.83 | MAPK1 (0.74) | MAPK1POLBLMNAGAASRD5A2 | |
| Methylamine SCHEMBL27262212 | 0.83 | MAPK1 (0.74) | MAPK1POLBLMNAGAASRD5A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107106561-A | Heparan sulfate biosynthesis inhibitor for treating disease | 生物马林药物股份有限公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-106279172-A | Purinone compound as inhibitors of kinases | 药品循环有限责任公司 | 2017-01-04 | — | — | CN | disclosed |
| CN-104640861-B | Purinone compounds as kinase inhibitors | 药品循环公司 | 2016-08-24 | — | — | CN | disclosed |