Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 known ✓ | Q9H244 | 9/20 | 0.64 |
| ▸ | P2RY4 known ✓ | P51582 | 10/20 | 0.62 |
| ▸ | P2RY2 known ✓ | P41231 | 6/20 | 0.62 |
| ▸ | P2RY6 known ✓ | Q15077 | 3/20 | 0.61 |
| ▸ | P2RY1 known ✓ | P47900 | 2/20 | 0.61 |
| ▸ | CDK2 | P24941 | 2/20 | 0.61 |
| ▸ | ENTPD1 | P49961 | 2/20 | 0.60 |
| ▸ | ENTPD2 | Q9Y5L3 | 1/20 | 0.60 |
| ▸ | MET | P08581 | 1/20 | 0.59 |
| ▸ | HGF | P14210 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL8644580 | 0.93 | GNG2 (0.63) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL3032357 | 0.86 | P2RY12 (0.77) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL10887955 | 0.85 | P2RY4 (0.69) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL8647025 | 0.84 | GNG2 (0.63) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL8634575 | 0.81 | GNG2 (0.63) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL10488650 | 0.81 | GNG2 (0.78) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL3032350 | 0.79 | P2RY4 (0.80) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL3026035 | 0.78 | P2RY12 (0.84) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL29533947 | 0.78 | P2RY4 (0.96) | P2RY12P2RY4P2RY2P2RY6CDK2 | |
| SCHEMBL3022506 | 0.78 | P2RY12 (1.00) | P2RY12P2RY4P2RY2P2RY6CDK2 |
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-4631341-A | DYEING COTTON IN BRILLIANT BLUE COLOR; EXCELLENT FASTNERSS, BUILD-UP | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-12-23 | — | — | US | disclosed |