Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.42 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.41 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 5/20 | 0.39 |
| ▸ | BACE1 | P56817 | 5/20 | 0.39 |
| ▸ | BCHE | P06276 | 4/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | FABP6 | P51161 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | EBP | Q15125 | 1/20 | 0.35 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12493264 | 0.70 | OPRM1 (0.43) | OPRM1OPRL1CARM1PRMT6ACHE | |
| SCHEMBL12699140 | 0.70 | OPRM1 (0.43) | OPRM1OPRL1CARM1PRMT6ACHE | |
| SCHEMBL19857407 | 0.69 | OPRM1 (0.44) | OPRM1OPRL1ACHEBACE1BCHE | |
| SCHEMBL19857422 | 0.69 | OPRM1 (0.44) | OPRM1OPRL1ACHEBACE1BCHE | |
| SCHEMBL16386245 | 0.68 | GRIN2B (0.44) | OPRM1OPRL1CARM1PRMT6ACHE | |
| SCHEMBL31682505 | 0.68 | GRIN2B (0.44) | OPRM1OPRL1ACHEBACE1BCHE | |
| SCHEMBL21744620 | 0.67 | OPRM1 (0.65) | OPRM1OPRL1CARM1PRMT6ACHE | |
| SCHEMBL1347780 | 0.67 | OPRM1 (0.46) | OPRM1OPRL1CARM1PRMT6ACHE | |
| SCHEMBL16612546 | 0.67 | OPRM1 (0.40) | OPRM1OPRL1GRIN2B | |
| SCHEMBL12859663 | 0.67 | CXCR3 (0.58) | OPRM1OPRL1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1155001-A4 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | LION BIOSCIENCE AG (DE) | 2003-05-28 | — | — | EP | claimed |
| EP-1155001-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | TREGA BIOSCIENCES, INC. (US) | 2001-11-21 | — | — | EP | claimed |
| WO-2000050406-A1 | ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES | LION BIOSCIENCE AG (DE) | 2000-08-31 | — | — | WO | claimed |