Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12631461 | 0.72 | LMNA (0.53) | IDO1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11732770 | 0.72 | IDO1 (0.61) | IDO1ALDH1A1HPGDMAPK1HSD17B10 | |
| SCHEMBL28422987 | 0.72 | KDM4E (0.50) | IDO1KDM4EALDH1A1HPGDMAPK1 | |
| SCHEMBL29280167 | 0.72 | CA3 (0.41) | IDO1KDM4EALDH1A1POLBHPGD | |
| SCHEMBL11405325 | 0.69 | ARG1 (0.50) | IDO1 | |
| SCHEMBL14199204 | 0.69 | KDM4E (0.34) | IDO1KDM4EALDH1A1POLBHPGD | |
| SCHEMBL29280159 | 0.69 | ALOX5 (0.55) | KDM4EALDH1A1HPGDMAPK1HSD17B10 | |
| SCHEMBL14199206 | 0.69 | PTGDR2 (0.42) | ALDH1A1POLBMAPTSMN1; SMN2PKM | |
| SCHEMBL14752589 | 0.68 | ALDH1A1 (0.53) | KDM4EALDH1A1POLBHPGDHSD17B10 | |
| SCHEMBL29280158 | 0.68 | ALDH1A1 (0.61) | KDM4EALDH1A1HPGDHSD17B10MAPT |
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-2684874-B1 | Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors | CEPHALON INC (US) | 2017-05-17 | — | — | EP | disclosed |
| EP-2684874-A1 | Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors | Cephalon, Inc. (US) | 2014-01-15 | — | — | EP | disclosed |