Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 10/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL10782995 | 0.82 | LDHA (0.47) | DHODHMEN1KMT2ALDHALMNA | |
| SCHEMBL10778479 | 0.79 | TDP1 (0.45) | DHODHTDP1CTDSP1MAP2K4TAAR1 | |
| SCHEMBL10783965 | 0.79 | SMN1; SMN2 (0.53) | DHODHTDP1MEN1KMT2ALDHA | |
| SCHEMBL10781383 | 0.79 | LDHA (0.56) | DHODHMEN1KMT2ALDHALMNA | |
| SCHEMBL9907710 | 0.73 | HTR5A (0.52) | MAP2K4LDHA | |
| SCHEMBL11552012 | 0.72 | DHODH (0.49) | DHODHMEN1KMT2AMAP4K4LDHA | |
| SCHEMBL15161302 | 0.72 | MAP4K4 (0.81) | DHODHMAP4K4 | |
| SCHEMBL5024503 | 0.71 | LTB4R2 (0.51) | DHODHMEN1KMT2ALMNAMAPT | |
| SCHEMBL18573216 | 0.70 | CNR1 (0.42) | DHODHMEN1KMT2ALDHALMNA | |
| SCHEMBL9907712 | 0.70 | CSNK2A2 (0.52) | MAP2K4MAP4K4LDHA |
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-0105210-B1 | ISOQUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-03-04 | — | — | EP | disclosed |