Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL16473797 | 0.83 | KDM4E (0.42) | PDPK1KDM4EMAPTATMHTR1A | |
| SCHEMBL2737054 | 0.81 | HTR1A (0.55) | HTR2AHTR1AHTR2CHTR2BEGFR | |
| SCHEMBL188260 | 0.75 | SRC (0.43) | KDM4EMAPTATMALDH1A1 | |
| SCHEMBL17417809 | 0.75 | PRKAG1 (0.53) | KDM4EALDH1A1 | |
| SCHEMBL9732348 | 0.75 | ALDH1A1 (0.56) | PDPK1KDM4EMAPTALDH1A1 | |
| SCHEMBL2736978 | 0.75 | IMPDH2 (0.45) | KDM4EMAPTHTR2AALDH1A1MEN1 | |
| SCHEMBL23207583 | 0.74 | IDO1 (0.46) | ATMHTR2AHTR2CEGFRMEN1 | |
| SCHEMBL256579 | 0.74 | KDM4E (0.50) | PDPK1KDM4EMAPTALDH1A1MEN1 | |
| SCHEMBL31077721 | 0.73 | PRKAB2 (0.43) | KDM4E | |
| SCHEMBL4419308 | 0.73 | IMPDH2 (0.34) | KDM4EMAPTHTR2AHTR2CALDH1A1 |
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-2402314-A1 | (Aza)indole derivative and use thereof for medical purposes | Kissei Pharmaceutical Co., Ltd. (JP) | 2012-01-04 | — | — | EP | disclosed |