Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 4/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 4/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | PTGFR | P43088 | 1/20 | 0.36 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.36 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.36 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28491847 | 0.89 | HRH3 (0.38) | PTGER4PTGDRHTR1AHTR2BTBXA2R | |
| SCHEMBL28484335 | 0.89 | CCR3 (0.36) | PTGER4PTGDRTBXA2RPTGER1PTGFR | |
| SCHEMBL28487960 | 0.88 | CYP19A1 (0.39) | NPC1MAOBPIN1RAB9AHTR1A | |
| SCHEMBL28487995 | 0.82 | EGLN2 (0.39) | NPC1RAB9APTGER4PTGDRDRD2 | |
| SCHEMBL29518204 | 0.81 | STING1 (0.48) | NPC1MAOBRAB9APTGER4PTGDR | |
| SCHEMBL12584456 | 0.81 | STING1 (0.48) | NPC1MAOBRAB9APTGER4PTGDR | |
| SCHEMBL22276161 | 0.80 | GPR52 (0.43) | NPC1MAOBHTR1AHTR2BDRD2 | |
| SCHEMBL12584451 | 0.80 | KDM4E (0.50) | NPC1RAB9AHTR1AHTR2BDRD2 | |
| SCHEMBL30272259 | 0.79 | PTGER4 (0.39) | MAOBRAB9APTGER4PTGDRHTR1A | |
| SCHEMBL987404 | 0.79 | KDM4E (0.39) | NPC1MAOBRAB9AHTR1AHTR2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111989311-B | Compound for inhibiting PGE2/EP4 signal transduction, preparation method thereof and application thereof in medicines | 凯复(苏州)生物医药有限公司 | 2022-03-22 | — | — | CN | disclosed |
| CN-111989311-A | Compound for inhibiting PGE2/EP4 signal transduction, preparation method thereof and application thereof in medicines | 凯复(苏州)生物医药有限公司 | 2020-11-24 | — | — | CN | disclosed |