Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7096045 | 0.85 | LRRK2 (0.43) | NAMPTMAPK3MAPK1ROCK1ENPP1 | |
| SCHEMBL7094936 | 0.80 | TMEM97 (0.38) | ALDH1A1KDM4EENPP1MEN1LMNA | |
| SCHEMBL6992686 | 0.80 | AKT1 (0.46) | NAMPTSMN1; SMN2MEN1KMT2A | |
| SCHEMBL7889978 | 0.80 | CHEK1 (0.36) | ALDH1A1KDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL7003516 | 0.79 | AKT1 (0.45) | NAMPTALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7096228 | 0.79 | DNM2 (0.36) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL7094580 | 0.78 | RAB9A (0.46) | NAMPTKDM4ELRRK2 | |
| SCHEMBL7092191 | 0.78 | CXCR4 (0.51) | ALDH1A1MAPK1KDM4EROCK1SMN1; SMN2 | |
| SCHEMBL6998526 | 0.77 | PARP1 (0.47) | ALDH1A1PARP1KDM4EMAPTMEN1 | |
| Hydrochloric Acid SCHEMBL7006248 | 0.77 | PARP1 (0.46) | ALDH1A1PARP1KDM4EMAPTMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268437-A1 | INHIBITORS OF PROTEIN KINASES | Knoll GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2002030908-A1 | INHIBITORS OF PROTEIN KINASES | KNOLL GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |
| US-6297238-B1 | 3-ARYL PYRAZOLES WITH 4,5(3,4)-BICYCLIC RING FUSION WHICH ARE INHIBITORS OF PROTEIN KINASES PARTICULARLY TYROSINE KINASES AND SERINE/THREONINE KINASES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-02 | — | — | US | disclosed |