Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL377361 | 0.88 | RORC (0.40) | ALDH1A1KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL30761550 | 0.87 | ALDH1A1 (0.41) | ALDH1A1LMNACYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL377360 | 0.85 | ALDH1A1 (0.45) | ALDH1A1LMNAKDM4EMEN1KMT2A | |
| SCHEMBL15153786 | 0.83 | CYP1A2 (0.42) | ALDH1A1CYP1A2KDM4ESMN1; SMN2MAPK1 | |
| SCHEMBL3459786 | 0.80 | CYP1A2 (0.65) | ALDH1A1LMNACYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL9332771 | 0.80 | CYP2C9 (0.56) | ALDH1A1LMNACYP1A2SMN1; SMN2MEN1 | |
| SCHEMBL11534382 | 0.78 | MEN1 (0.65) | ALDH1A1CYP1A2KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL9518191 | 0.78 | MEN1 (0.55) | ALDH1A1LMNACYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL28751343 | 0.78 | ALDH1A1 (0.38) | ALDH1A1LMNACYP1A2KDM4ESMN1; SMN2 | |
| SCHEMBL2907594 | 0.77 | ALDH1A1 (0.51) | ALDH1A1LMNACYP1A2SMN1; SMN2MEN1 |
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-0406857-A1 | Proteins and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1991-01-09 | — | — | EP | disclosed |
| EP-0362879-A1 | Pyrogen-adsorbing polymers | Hirayama, Chuichi (JP) | 1990-04-11 | — | — | EP | disclosed |