Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 2/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.46 |
| ▸ | CNR2 | P34972 | 3/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1154024 | 0.91 | MCHR1 (0.57) | MCHR1HTR2ADNMT3AHDAC1HDAC6 | |
| SCHEMBL10181387 | 0.91 | DNMT3A (0.52) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL10181010 | 0.90 | DNMT3A (0.54) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL10182174 | 0.89 | DNMT3A (0.57) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL10181758 | 0.88 | DNMT3A (0.53) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL1154372 | 0.88 | MCHR1 (0.50) | MCHR1HTR2ADNMT3AHDAC1HDAC6 | |
| SCHEMBL10181170 | 0.87 | DNMT3A (0.52) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL10181435 | 0.87 | DNMT3A (0.48) | DNMT3AHDAC1HDAC6NLRP3CNR2 | |
| SCHEMBL10180600 | 0.87 | DNMT3A (0.49) | DNMT3AHDAC1HDAC6NLRP3AKR1C3 | |
| SCHEMBL10182210 | 0.86 | DNMT3A (0.54) | DNMT3AHDAC1HDAC6NLRP3AKR1C3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215065-B1 | CCR10 ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2012-07-11 | — | — | EP | claimed |