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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY4 known ✓ | P51582 | 11/20 | 0.69 |
| ▸ | P2RY2 known ✓ | P41231 | 8/20 | 0.69 |
| ▸ | P2RY1 known ✓ | P47900 | 4/20 | 0.63 |
| ▸ | THRB known ✓ | P10828 | 2/20 | 0.63 |
| ▸ | P2RY12 known ✓ | Q9H244 | 6/20 | 0.62 |
| ▸ | P2RY6 known ✓ | Q15077 | 2/20 | 0.62 |
| ▸ | MET | P08581 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | NSD2 | O96028 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | POLB | P06746 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.63 |
| ▸ | RECQL | P46063 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL11679423 | 0.94 | GNG2 (0.61) | P2RY4P2RY2METP2RY1MEN1 | |
| SCHEMBL11683034 | 0.86 | P2RY4 (0.49) | P2RY4P2RY2METP2RY1MEN1 | |
| SCHEMBL10885602 | 0.85 | P2RY12 (0.64) | P2RY4P2RY2METP2RY1P2RY12 | |
| SCHEMBL3032357 | 0.83 | P2RY12 (0.77) | P2RY4P2RY2METP2RY1P2RY12 | |
| SCHEMBL11433668 | 0.82 | GNG2 (0.65) | P2RY4P2RY2METP2RY1MEN1 | |
| SCHEMBL8646673 | 0.81 | P2RY4 (0.59) | P2RY4P2RY2METALDH1A1HPGD | |
| SCHEMBL791688 | 0.79 | P2RY4 (1.00) | P2RY4P2RY2METP2RY1P2RY12 | |
| SCHEMBL11602263 | 0.78 | P2RY4 (0.76) | P2RY4P2RY2METP2RY1MEN1 | |
| SCHEMBL3032350 | 0.78 | P2RY4 (0.80) | P2RY4P2RY2METP2RY1P2RY12 | |
| SCHEMBL30876547 | 0.78 | P2RY1 (0.72) | P2RY4P2RY2METP2RY1MEN1 |
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 |