Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | SRC | P12931 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | MDM4 | O15151 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5051442 | 0.81 | SRC (0.47) | KDM4EL3MBTL1SRCNPC1RAB9A | |
| SCHEMBL6981450 | 0.80 | AKT1 (0.52) | KDM4EL3MBTL1NPC1RAB9ACYP1A2 | |
| SCHEMBL6981483 | 0.78 | SRC (0.44) | KDM4EL3MBTL1SRCCYP1A2TP53 | |
| SCHEMBL6197534 | 0.77 | CASP3 (0.50) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28987534 | 0.77 | L3MBTL1 (0.72) | KDM4EL3MBTL1NPC1RAB9ATP53 | |
| SCHEMBL6054998 | 0.77 | L3MBTL1 (0.76) | KDM4EL3MBTL1POLBHPGDMEN1 | |
| SCHEMBL3316275 | 0.76 | SRC (0.45) | SRCPOLBMAPK1AKT1 | |
| SCHEMBL379494 | 0.75 | SRC (0.47) | KDM4EL3MBTL1SRCNPC1HTT | |
| SCHEMBL28028253 | 0.72 | SRC (0.45) | KDM4ESRCNPC1HTTSMN1; SMN2 | |
| SCHEMBL8207031 | 0.72 | L3MBTL1 (0.51) | KDM4EL3MBTL1NPC1RAB9ACYP1A2 |
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-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |