Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11924585 | 0.86 | CYP1A2 (0.47) | CYP1A2CYP2A6SSTR4PDPK1NPC1 | |
| SCHEMBL762341 | 0.77 | CYP1A2 (0.54) | CYP1A2CYP2A6SSTR4PDPK1NPC1 | |
| SCHEMBL4372845 | 0.74 | CYP1A2 (0.50) | CYP1A2CYP2A6SSTR4PDPK1NPC1 | |
| SCHEMBL26042691 | 0.74 | CYP1A2 (0.50) | CYP1A2CYP2A6SSTR4PDPK1NPC1 | |
| SCHEMBL5720524 | 0.71 | CYP1A2 (0.50) | CYP1A2CYP2A6SSTR4PDPK1NPC1 | |
| SCHEMBL26018132 | 0.71 | CYP1A2 (0.36) | CYP1A2HTR3AKDM4E | |
| SCHEMBL18427298 | 0.71 | SMN1; SMN2 (0.47) | CYP1A2L3MBTL1KDM4ETDP1 | |
| SCHEMBL19772870 | 0.70 | MAOB (0.38) | CYP1A2CYP2A6SSTR4PDPK1PDE10A | |
| SCHEMBL18869428 | 0.70 | CYP1A2 (0.42) | CYP1A2SSTR4KDM4E | |
| SCHEMBL19431779 | 0.70 | CYP1A2 (0.47) | CYP1A2CYP2A6RAB9AHTR3AKDM4E |
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-9975863-B2 | Modulators of sphingosine phosphate receptors | THE SCRIPPS RESEARCH INSTITUTE (US) | 2018-05-22 | — | — | US | disclosed |