Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12311979 | 0.87 | CRHBP (0.54) | CTSDHPGDALDH1A1L3MBTL1GPR35 | |
| SCHEMBL3897907 | 0.86 | CTSD (0.66) | CTSDHPGDALDH1A1L3MBTL1HTT | |
| SCHEMBL15630987 | 0.84 | TSHR (0.63) | HPGDPOLBALDH1A1L3MBTL1TSHR | |
| SCHEMBL15631005 | 0.84 | HPGD (0.47) | HPGDPOLBALDH1A1L3MBTL1KEAP1 | |
| SCHEMBL17442116 | 0.83 | HPGD (0.46) | CTSDHPGDPOLBALDH1A1L3MBTL1 | |
| SCHEMBL10435791 | 0.82 | HPGD (0.54) | CTSDHPGDPOLBALDH1A1L3MBTL1 | |
| SCHEMBL782110 | 0.81 | CTSD (0.73) | CTSDHPGDPOLBALDH1A1GPR35 | |
| SCHEMBL15610644 | 0.81 | L3MBTL1 (0.51) | CTSDPOLBALDH1A1L3MBTL1GPR35 | |
| SCHEMBL6776994 | 0.81 | L3MBTL1 (0.46) | CTSDHPGDALDH1A1L3MBTL1KEAP1 | |
| SCHEMBL30893562 | 0.79 | TSHR (0.68) | CTSDPOLBALDH1A1L3MBTL1GPR35 |
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-1639115-A | Semicarbazide derivatives and their use as antithrombotics | MERCK PATENT GMBH (DE) | 2005-07-13 | — | — | CN | disclosed |
| CN-1639150-A | Isoquinoline derivatives | MERCK PATENT GMBH (DE) | 2005-07-13 | — | — | CN | disclosed |