Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 8/20 | 0.64 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 2/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.39 |
| ▸ | POLQ | O75417 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.35 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19360545 | 1.00 | RORC (0.64) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL28895765 | 0.92 | RORC (0.56) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL28285110 | 0.92 | RORC (0.55) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL28895622 | 0.90 | RORC (0.54) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL20822477 | 0.89 | RORC (0.52) | RORCPPARGMRGPRX4EPHX2PLA2G4A | |
| SCHEMBL28285097 | 0.88 | RORC (0.55) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL19360544 | 0.88 | RORC (0.65) | RORCPPARGMRGPRX4POLQEPHX2 | |
| SCHEMBL29465606 | 0.88 | RORC (0.65) | RORCPPARGMRGPRX4POLQEPHX2 | |
| SCHEMBL22238330 | 0.88 | RORC (0.51) | RORCPPARGCCR2MRGPRX4POLQ | |
| SCHEMBL22238305 | 0.87 | RORC (0.51) | RORCPPARGCCR2MRGPRX4POLQ |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109963836-B | Deuterium atom substituted indole carboxamide derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |
| CN-113227048-B | Crystal form of indole carboxamide derivative and preparation method thereof | 江苏恒瑞医药股份有限公司 | 2022-04-12 | — | — | CN | disclosed |
| CN-113365980-B | Crystal form of deuterium atom substituted indole formamide derivative and preparation method thereof | 江苏恒瑞医药股份有限公司 | 2022-04-12 | — | — | CN | disclosed |