Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Adenosine Triphosphate. 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 | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 8/20 | 0.79 |
| ▸ | P2RY11 | Q96G91 | 3/20 | 0.79 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.76 |
| ▸ | BLM | P54132 | 2/20 | 0.75 |
| ▸ | TSHR | P16473 | 1/20 | 0.75 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.75 |
| ▸ | LMNA | P02545 | 1/20 | 0.75 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.73 |
| ▸ | SRC | P12931 | 2/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.73 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.73 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.73 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.73 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.73 |
| ▸ | TRPM2 | O94759 | 2/20 | 0.73 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.73 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.73 |
| ▸ | LDHA | P00338 | 1/20 | 0.73 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.73 |
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 | |
|---|---|---|---|---|
| Adenosine Triphosphate SCHEMBL3134374 | 1.00 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL29905572 | 0.99 | P2RY1 (0.80) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL29576424 | 0.99 | P2RY1 (0.80) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL193646 | 0.99 | P2RY1 (0.80) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL30606657 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL31149196 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL924732 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL29017896 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL28608115 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR | |
| Adenosine Triphosphate SCHEMBL29670849 | 0.98 | P2RY1 (0.79) | P2RY1P2RY11ENPP1BLMTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110947034-B | Bioactive calcium phosphate/fibrin compounded injectable bone repair hydrogel | 上海市第十人民医院 | 2022-05-27 | — | — | CN | disclosed |