Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14044130 | 0.81 | CYP1A2 (0.72) | PKMCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL21574677 | 0.77 | PKM (0.45) | PKMPLA2G2ACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9724222 | 0.76 | LMNA (0.56) | PKMCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL18856452 | 0.75 | RORC (0.58) | PKMPLA2G2ARORC | |
| SCHEMBL21004452 | 0.75 | PKM (0.56) | PKMCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9724245 | 0.74 | LMNA (0.55) | PKMCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9593290 | 0.73 | LMNA (0.62) | PKMCYP1A2ALDH1A1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL27551107 | 0.73 | LMNA (0.53) | PKMCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27961718 | 0.73 | MAOA (0.67) | PKMALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL16462100 | 0.71 | CYP1A2 (0.61) | CYP1A2CYP2D6CYP2C9CYP2C19RXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3057951-B1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2019-11-20 | — | — | EP | disclosed |