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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.41 |
| ▸ | ACR | P10323 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5671105 | 0.87 | KMT2A (0.45) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL8976348 | 0.84 | CYP2D6 (0.46) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL9780681 | 0.81 | LMNA (0.50) | CYP1A2CYP2C9CYP2D6MAPK1LMNA | |
| SCHEMBL715065 | 0.80 | CYP2D6 (0.47) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL22089693 | 0.80 | CYP2D6 (0.47) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL22090243 | 0.80 | CYP2D6 (0.47) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL22089696 | 0.80 | CYP2D6 (0.47) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL16212878 | 0.77 | KMT2A (0.45) | KMT2AMEN1CYP1A2CYP2C9PRSS1 | |
| SCHEMBL31504465 | 0.76 | ALDH1A1 (0.50) | KMT2AMEN1CYP1A2CYP2C9CYP2D6 | |
| SCHEMBL10477688 | 0.75 | PRSS1 (0.43) | KMT2AMEN1CYP1A2CYP2C9PRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5003099-A | Method for the production of aminocyanoacetamide | LONZA LTD. (CH) | 1991-03-26 | — | — | US | disclosed |