Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7006694 | 0.83 | LMNA (0.41) | LMNAGLAALDH1A1L3MBTL1HCRTR1 | |
| SCHEMBL9588003 | 0.83 | VHL (0.47) | LMNAGLAALDH1A1L3MBTL1HCRTR1 | |
| SCHEMBL7008778 | 0.77 | LMNA (0.44) | LMNAGLAALDH1A1L3MBTL1HCRTR1 | |
| SCHEMBL27341838 | 0.75 | LMNA (0.35) | LOXL2LMNAGLAKDM4E | |
| SCHEMBL4584394 | 0.74 | LMNA (0.45) | LMNAGLAALDH1A1L3MBTL1HCRTR1 | |
| SCHEMBL8222266 | 0.73 | LMNA (0.39) | LMNAGLAALDH1A1L3MBTL1HCRTR1 | |
| SCHEMBL27362396 | 0.73 | LOXL2 (0.43) | LOXL2HRH3TAAR1ABATNSD2 | |
| SCHEMBL7436851 | 0.73 | ADRA1D (0.49) | — | |
| SCHEMBL7051197 | 0.73 | LOXL2 (0.40) | LOXL2ALDH1A1HRH3TAAR1ABAT | |
| SCHEMBL27355509 | 0.73 | PNMT (0.39) | LOXL2HRH3TAAR1PKMABAT |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102850332-A | 1-(2,6-Dichlorophenyl)-3-n-butyl-1,4-dihydro-4-[4-[2-(1H-tetrazole-5-yl)-1H-pyrrole-1-yl]phenylmethyl]-5H-1,2,4-triazole-5-one with cardiovascular activity and synthesis process of medicinal salt thereof | UNIV CHINA PHARMA | 2013-01-02 | — | — | CN | disclosed |
| CN-1257158-C | N-aryl substituted-1H-pyrrole derivative possessing cardiovascular activity | UNIV CHINA PHARMA (CN) | 2006-05-24 | — | — | CN | disclosed |
| CN-1544418-A | N-aryl substituted-1H-pyrrole derivative possessing cardiovascular activity | 中国药科大学 | 2004-11-10 | — | — | CN | disclosed |
| EP-0628559-B1 | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF LILLY GMBH (DE) | 2002-04-03 | — | — | EP | disclosed |
| US-5602137-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5602136-A | Pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5571813-A | Fused pyrimidine compounds and their use as pharmaceuticals | BEIERSDORF-LILLY GMBH (DE) | 1996-11-05 | — | — | US | disclosed |
| EP-0628559-A1 | Pyrimidine compounds and their use as pharmaceuticals | Beiersdorf-Lilly GmbH (DE) | 1994-12-14 | — | — | EP | disclosed |