Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Phthalic Acid. 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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 5/20 | 0.50 |
| ▸ | HMGB1 | P09429 | 2/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | GGT1 | P19440 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Phthalic Acid SCHEMBL28120443 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| Phthalic Acid SCHEMBL3106 | 0.98 | ALDH1A1 (0.54) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| Phthalic Acid SCHEMBL27946592 | 0.96 | ALDH1A1 (0.52) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| SCHEMBL5535925 | 0.91 | ALDH1A1 (0.47) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| SCHEMBL4372406 | 0.89 | ALDH1A1 (0.44) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| Toluic Acid SCHEMBL27660801 | 0.88 | ALDH1A1 (0.50) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| Acetic Acid SCHEMBL8442986 | 0.87 | ALDH1A1 (0.50) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| Anthranilic Acid SCHEMBL28763510 | 0.86 | HSD17B10 (0.46) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| SCHEMBL27553780 | 0.86 | ALDH1A1 (0.61) | ALDH1A1ALOX15KDM4EHSD17B10HPGD | |
| SCHEMBL27493128 | 0.86 | KDM4E (0.45) | ALDH1A1ALOX15KDM4EHSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-106310276-A | Pharmaceutical composition containing sugar and lipid reducing medicine and aspirin and folic acid | 深圳奥萨制药有限公司 | 2017-01-11 | — | — | CN | disclosed |
| CN-106310277-A | Pharmaceutical composition containing sugar reducing medicine, aspirin and folic acid | 深圳奥萨制药有限公司 | 2017-01-11 | — | — | CN | disclosed |