Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | F7 | P08709 | 4/20 | 0.37 |
| ▸ | F2 | P00734 | 3/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | TMPRSS6 | Q8IU80 | 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 | |
|---|---|---|---|---|
| SCHEMBL7669697 | 0.85 | MAPK13 (0.40) | ALDH1A1L3MBTL1HPGDRAB9AF2 | |
| SCHEMBL7678092 | 0.85 | F2 (0.40) | ALDH1A1L3MBTL1HPGDRAB9AF7 | |
| SCHEMBL6563625 | 0.80 | PRSS1 (0.43) | ALDH1A1L3MBTL1HPGDRAB9AF7 | |
| SCHEMBL6561921 | 0.76 | MAPK13 (0.45) | ALDH1A1L3MBTL1HPGDMAPTHTT | |
| SCHEMBL6561914 | 0.74 | GRM5 (0.43) | ALDH1A1HPGDRAB9AF2PRSS1 | |
| SCHEMBL6563277 | 0.74 | F2 (0.41) | F7F2F10PLAUPRSS1 | |
| SCHEMBL7675043 | 0.74 | F7 (0.42) | F7F2F10PLAUPRSS1 | |
| SCHEMBL7673754 | 0.73 | NQO2 (0.41) | ALDH1A1HPGDMAPTCYP2C9CYP2C19 | |
| SCHEMBL6565690 | 0.71 | PLAU (0.54) | HTTRAB9AF2F10PLAU | |
| SCHEMBL6565256 | 0.71 | AKR1C3 (0.44) | ALDH1A1F7F2F10PLAU |
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-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |
| US-6479524-B1 | TO PROLONG THE THROMBIN TIME | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2002-11-12 | — | — | US | disclosed |