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 2)
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 | |
|---|---|---|---|---|
| SCHEMBL1860664 | 0.96 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Abt-102 SCHEMBL29388297 | 0.89 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Abt-102 SCHEMBL29857846 | 0.89 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Abt-102 SCHEMBL1854692 | 0.89 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Abt-102 SCHEMBL1857275 | 0.89 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Abt-102 SCHEMBL1859296 | 0.89 | TRPV1 (1.00) | TRPV1TRPV4 | |
| Acetic Acid SCHEMBL27762603 | 0.86 | TRPV1 (0.93) | TRPV1TRPV4 | |
| SCHEMBL1854750 | 0.86 | TRPV1 (0.83) | TRPV1TRPV4 | |
| SCHEMBL1859323 | 0.86 | TRPV1 (0.83) | TRPV1TRPV4 | |
| SCHEMBL1859424 | 0.86 | TRPV1 (1.00) | TRPV1TRPV4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102617464-A | fused compounds that inhibit vanilloid receptor subtype 1 (vr1) receptor | ABBOTT LAB | 2012-08-01 | — | — | CN | claimed |
| CN-1835924-A | Fused compounds that inhibit vanilloid receptor subtype 1(vr1) receptor | ABBOTT LAB (US) | 2006-09-20 | — | — | CN | claimed |
| CN-1835924-A | Fused compounds that inhibit vanilloid receptor subtype 1(vr1) receptor | ABBOTT LAB (US) | 2006-09-20 | — | — | CN | disclosed |