Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 6/20 | 0.60 |
| ▸ | FLT4 | P35916 | 4/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 10/20 | 0.49 |
| ▸ | FLT3 | P36888 | 10/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | KIT | P10721 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14617565 | 0.90 | PTK2 (0.68) | PTK2FLT4CHEK1FLT3 | |
| SCHEMBL12478948 | 0.90 | PTK2 (0.67) | PTK2FLT4CHEK1FLT3 | |
| SCHEMBL14617566 | 0.88 | PTK2 (0.67) | PTK2FLT4CHEK1FLT3JAK2 | |
| SCHEMBL14617567 | 0.88 | PTK2 (0.78) | PTK2FLT4 | |
| Lithium Ion SCHEMBL12478946 | 0.88 | PTK2 (0.66) | PTK2FLT4CHEK1FLT3 | |
| Acetic Acid SCHEMBL27933736 | 0.84 | PTK2 (0.65) | PTK2FLT4KDRJAK2JAK3 | |
| Acetic Acid SCHEMBL27949164 | 0.83 | PTK2 (0.61) | PTK2FLT4KDR | |
| Acetic Acid SCHEMBL27949165 | 0.83 | PTK2 (0.65) | PTK2FLT4KDR | |
| Acetic Acid SCHEMBL27949152 | 0.82 | PTK2 (0.62) | PTK2FLT4KDR | |
| Acetic Acid SCHEMBL27933737 | 0.81 | PTK2 (0.62) | PTK2FLT4KDR |
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 |
|---|---|---|---|---|---|---|---|
| CN-103534241-A | Fak inhibitor | CANCER THERAPEUTICS CRC PTY LTD | 2014-01-22 | — | — | CN | disclosed |