Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 4/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27984593 | 1.00 | HTR1D (0.43) | HTR1DMRGPRX4TP53CYP1A2CYP3A4 | |
| SCHEMBL10807597 | 0.82 | TDP1 (0.49) | HTR1DMRGPRX4TP53CYP1A2CYP3A4 | |
| SCHEMBL27984242 | 0.81 | HTR1D (0.37) | HTR1DMRGPRX4TP53CYP1A2CYP3A4 | |
| SCHEMBL27984337 | 0.81 | HTR1D (0.37) | HTR1DMRGPRX4TP53CYP1A2CYP3A4 | |
| SCHEMBL27984634 | 0.79 | MEN1 (0.42) | MRGPRX4CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL27984596 | 0.79 | MAPT (0.51) | MRGPRX4CYP1A2CYP3A4TSHRCYP2C19 | |
| SCHEMBL27984300 | 0.76 | MAPT (0.40) | TSHRTDP1KMT2AALDH1A1GAA | |
| SCHEMBL27984338 | 0.75 | PPARD (0.47) | L3MBTL1RAB9APOLB | |
| SCHEMBL28759964 | 0.74 | MEN1 (0.45) | KMT2AALDH1A1L3MBTL1KDM4EMAPT | |
| SCHEMBL5235490 | 0.74 | MRGPRX4 (0.50) | HTR1DMRGPRX4TP53CYP1A2CYP3A4 |
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-102007118-B | Pyrrolidinone glucokinase activators | HOFFMANN LA ROCHE | 2014-12-31 | — | — | CN | disclosed |