Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 3/20 | 0.38 |
| ▸ | HTR1D | P28221 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | CASP6 | P55212 | 2/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14048027 | 0.85 | ALDH1A1 (0.44) | ALDH1A1KMT2AMCOLN3HTR7HTR1D | |
| SCHEMBL5132145 | 0.83 | HTR7 (0.57) | ALDH1A1KMT2AMCOLN3HTR7HTR1D | |
| SCHEMBL3441492 | 0.82 | HCRTR1 (0.48) | ALDH1A1KMT2AMCOLN3OPRM1OPRK1 | |
| SCHEMBL699933 | 0.82 | HCRTR1 (0.48) | ALDH1A1KMT2AMCOLN3OPRM1OPRK1 | |
| SCHEMBL3634695 | 0.81 | TSHR (0.47) | ALDH1A1KMT2AMCOLN3AKR1C3HTR7 | |
| SCHEMBL2564263 | 0.78 | BDKRB1 (0.48) | ALDH1A1KMT2AMCOLN3KDM4EHTR7 | |
| SCHEMBL5132594 | 0.77 | ATM (0.46) | ATMCASP3CASP7TDP1 | |
| SCHEMBL5093730 | 0.76 | PSEN1 (0.62) | ALDH1A1KMT2ACASP3CASP7 | |
| SCHEMBL2569069 | 0.76 | FKBP1A (0.48) | ALDH1A1CASP3CASP1CASP7CASP6 | |
| SCHEMBL4537339 | 0.75 | ATM (0.49) | ATMALDH1A1KMT2AMCOLN3OPRM1 |
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-2155678-A1 | NEW BRADYKININ B1 ANTAGONISTS | EVOTEC Neurosciences GmbH (DE) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008125570-A1 | NEW BRADYKININ B1 ANTAGONISTS | EVOTEC NEUROSCIENCES GMBH (DE) | 2008-10-23 | — | — | WO | disclosed |