Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.74 |
| ▸ | MEN1 | O00255 | 3/20 | 0.74 |
| ▸ | GAA | P10253 | 1/20 | 0.70 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | CA7 | P43166 | 1/20 | 0.67 |
| ▸ | CA9 | Q16790 | 1/20 | 0.67 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.66 |
| ▸ | KDM1A | O60341 | 2/20 | 0.63 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.61 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.61 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.61 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.61 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.61 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.61 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.61 |
| ▸ | MAOA | P21397 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL22728797 | 1.00 | KMT2A (0.74) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL7850864 | 0.87 | KMT2A (0.76) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL28682324 | 0.87 | KMT2A (0.76) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL16979273 | 0.86 | KMT2A (0.67) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL11711099 | 0.86 | KMT2A (0.74) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL30789064 | 0.86 | KMT2A (0.74) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL15558738 | 0.86 | KMT2A (0.74) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL24724688 | 0.85 | KMT2A (0.74) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL14646680 | 0.85 | KMT2A (1.00) | KMT2AMEN1GAACA1CA2 | |
| SCHEMBL7849270 | 0.85 | KMT2A (1.00) | KMT2AMEN1GAACA1CA2 |
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-1288148-C | 1,2,3,4-tetrahydroisoquinolines derivatives as urotensin II receptor antagonists | ACTELION PHARMACEUTICALS LTD (CH) | 2006-12-06 | — | — | CN | disclosed |
| US-4001244-A | 1-ARYL-3,4-DIHYDRO-2(1H)-ISOQUINOLINE CARBONYL CHLORIDES | G. D. SEARLE & CO. (US) | 1977-01-04 | — | — | US | disclosed |