Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 7/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | DDR1 | Q08345 | 6/20 | 0.34 |
| ▸ | DDR2 | Q16832 | 6/20 | 0.34 |
| ▸ | ABL1 | P00519 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7658810 | 0.90 | NPC1 (0.37) | NPC1RAB9ARORCKMT2ADDR1 | |
| SCHEMBL7654987 | 0.82 | ROCK2 (0.43) | DDR1DDR2ROCK2 | |
| SCHEMBL7652045 | 0.81 | NPC1 (0.34) | NPC1RAB9ARORCKMT2ADDR1 | |
| SCHEMBL7658777 | 0.78 | NPC1 (0.54) | NPC1RAB9AKMT2APOLBLMNA | |
| SCHEMBL7650138 | 0.78 | MAPT (0.50) | NPC1RAB9AKMT2APOLBLMNA | |
| SCHEMBL7662349 | 0.77 | MAPT (0.34) | RAB9AKMT2ADDR1DDR2POLB | |
| SCHEMBL7658606 | 0.76 | RORC (0.41) | RORCPOLBROCK2 | |
| SCHEMBL6805375 | 0.74 | ABL1 (0.40) | DDR1DDR2ABL1ROCK2 | |
| SCHEMBL7654645 | 0.74 | KIT (0.39) | RAB9ADDR1 | |
| SCHEMBL7653451 | 0.74 | MAPT (0.41) | NPC1RAB9AKMT2ALMNAROCK2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | claimed |
| EP-1104404-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES AND THEIR USE AS ANTICONVULSANTS | SMITHKLINE BEECHAM PLC (GB) | 2001-06-06 | — | — | EP | claimed |
| WO-2000009486-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES AND THEIR USE AS ANTICONVULSIVANTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-02-24 | — | — | WO | claimed |
| US-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | disclosed |
| EP-1104404-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES AND THEIR USE AS ANTICONVULSANTS | SMITHKLINE BEECHAM PLC (GB) | 2001-06-06 | — | — | EP | disclosed |
| WO-2000009486-A1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES AND THEIR USE AS ANTICONVULSIVANTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-02-24 | — | — | WO | disclosed |