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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 known ✓ | P00519 | 20/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | BCR | P11274 | 1/20 | 0.56 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL30091177 | 0.94 | ABL1 (0.66) | ABL1KCNH2BCRCRBN | |
| SCHEMBL28902246 | 0.94 | ABL1 (0.66) | ABL1KCNH2BCRCRBN | |
| SCHEMBL23929297 | 0.93 | ABL1 (0.61) | ABL1KCNH2BCRCRBN | |
| SCHEMBL21477626 | 0.92 | ABL1 (0.70) | ABL1KCNH2BCRCRBN | |
| SCHEMBL22711583 | 0.92 | ABL1 (0.70) | ABL1KCNH2BCRCRBN | |
| Bromide SCHEMBL28902250 | 0.91 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Bromide SCHEMBL30091102 | 0.91 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL28902254 | 0.91 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL30091086 | 0.91 | ABL1 (0.69) | ABL1KCNH2BCRCRBN | |
| Hydrochloric Acid SCHEMBL28902253 | 0.91 | ABL1 (0.69) | ABL1KCNH2BCRCRBN |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117304171-A | Solid forms of pyrazine substituted nicotinamide, preparation and use thereof | 深圳市塔吉瑞生物医药有限公司 | 2023-12-29 | — | — | CN | disclosed |
| CN-115413277-B | Solid forms of pyrazine substituted nicotinamide, preparation and use thereof | 深圳市塔吉瑞生物医药有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-115413277-A | Solid forms of pyrazine-substituted nicotinamide, their preparation and use | 深圳市塔吉瑞生物医药有限公司 | 2022-11-29 | — | — | CN | disclosed |
| WO-2021213380-A1 | SOLID FORM OF PYRAZINE SUBSTITUTED NICOTINAMIDE, AND PREPARATION AND USE THEREOF | 深圳市塔吉瑞生物医药有限公司 (CN) | 2021-10-28 | — | — | WO | disclosed |