Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO
The experimentally established mechanism targets of Adenine. 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 | |
|---|---|---|---|---|
| ▸ | PI4KA | P42356 | 2/20 | 0.79 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.79 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.79 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.79 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.76 |
| ▸ | LMNA | P02545 | 1/20 | 0.76 |
| ▸ | DRD3 | P35462 | 1/20 | 0.76 |
| ▸ | XDH | P47989 | 1/20 | 0.76 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.44 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.44 |
| ▸ | G6PD | P11413 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Adenine SCHEMBL27690902 | 0.98 | PI4KA (0.79) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL30565251 | 0.98 | PI4KA (0.79) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL40371 | 0.98 | PI4KA (0.79) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL29546720 | 0.98 | PI4KA (0.79) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL31229444 | 0.97 | PI4KA (0.76) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL27773965 | 0.97 | PI4KA (0.76) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL27470942 | 0.97 | PI4KA (0.76) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL6308303 | 0.97 | PI4KA (0.76) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL5663798 | 0.92 | PI4KA (0.73) | PI4KAPI4K2BPI4K2API4KBLRRK2 | |
| Adenine SCHEMBL11798396 | 0.89 | PI4KA (1.00) | PI4KAPI4K2BPI4K2API4KBLRRK2 |
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-5968788-A | CULTURING CANDIDA FAMATA, CANDIDA GUILLIERMONDII, YARROWIA LIPOLYTICA, PICHIA GLUCOZYMA, OR SACCHAROMYCES CEREVISIAE IN MEDIUM WITH GLUCOSE, FRUCTOSE, SUCROSE, OR MALTOSE; RECOVERING AT LEAST 0.3 MILLIGRAMS FOLIC ACID PER LITER MEDIA | TORAY INDUSTRIES, INC. (JP) | 1999-10-19 | — | — | US | disclosed |