Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO
The experimentally established mechanism targets of Sulfuric 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 | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2902418 | 0.93 | PIN1 (0.50) | PIN1ALDH1A1KDM4ETDP1HPGD | |
| SCHEMBL13368245 | 0.74 | LMNA (0.46) | ALDH1A1KDM4ELMNAMAPTMMP2 | |
| SCHEMBL2894057 | 0.73 | MMP2 (0.41) | LMNAMMP2MMP1MMP9 | |
| Pyrrole SCHEMBL11485524 | 0.71 | C3AR1 (0.47) | PIN1ALDH1A1TDP1POLBKMT2A | |
| Sulfuric Acid SCHEMBL28371934 | 0.71 | ALDH1A1 (0.57) | ALDH1A1KDM4ETDP1HPGDGMNN | |
| SCHEMBL1083036 | 0.70 | GABRA1 (0.55) | LMNAMMP2MMP1MMP9C3AR1 | |
| Water SCHEMBL5369986 | 0.66 | BAZ2B (0.53) | PIN1ALDH1A1KDM4EHPGDLMNA | |
| Lithium SCHEMBL30440316 | 0.66 | ALDH1A1 (0.38) | ALDH1A1TDP1KMT2ASRCADRA2A | |
| Hydrochloric Acid SCHEMBL15956816 | 0.66 | ALDH1A1 (0.38) | ALDH1A1TDP1KMT2ASRCADRA2A | |
| SCHEMBL29012461 | 0.66 | ALDH1A1 (0.38) | ALDH1A1TDP1KMT2ASRCADRA2A |
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-4038286-A | RACEMATES AND OPTICAL ISOMERS OF 1-(1-PHENYLETHYL)-1H-IMIDAZOLE-5-CARBOYLIC ACID DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-07-26 | — | — | US | disclosed |