Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8751571 | 0.83 | LMNA (0.47) | CYP2D6KMT2AMTORMEN1GAA | |
| SCHEMBL689805 | 0.79 | ALDH1A1 (0.42) | CYP2D6KMT2AMEN1LMNAALDH1A1 | |
| SCHEMBL12067933 | 0.79 | ALDH1A1 (0.42) | CYP2D6KMT2AMEN1LMNAALDH1A1 | |
| SCHEMBL17846081 | 0.77 | CYP2D6 (0.39) | CYP2D6KMT2AMEN1SRCLMNA | |
| SCHEMBL19348988 | 0.77 | CYP2D6 (0.39) | CYP2D6KMT2AMEN1SRCLMNA | |
| SCHEMBL532309 | 0.77 | CYP2D6 (0.39) | CYP2D6KMT2AMEN1SRCLMNA | |
| SCHEMBL11778053 | 0.74 | ALDH1A1 (0.38) | CYP2D6KMT2AMTORLMNAALOX5 | |
| SCHEMBL1520362 | 0.74 | MTOR (0.62) | CYP2D6KMT2AMTORMEN1GAA | |
| Benzene SCHEMBL28986126 | 0.74 | MTOR (0.62) | CYP2D6KMT2AMTORMEN1GAA | |
| SCHEMBL27758907 | 0.73 | HTR2A (0.41) | CYP2D6LMNAALDH1A1TDP1 |
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-2331518-A1 | NEW BRADYKININ B1 ANTAGONISTS | Evotec AG (DE) | 2011-06-15 | — | — | EP | disclosed |
| WO-2010020556-A1 | NEW BRADYKININ B1 ANTAGONISTS | EVOTEC NEUROSCIENCES GMBH (DE) | 2010-02-25 | — | — | WO | disclosed |