Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 8/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7658184 | 0.88 | RORC (0.49) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7658566 | 0.87 | MAPT (0.58) | MEN1KMT2ANPC1SMN1; SMN2TP53 | |
| SCHEMBL7649761 | 0.77 | MAPT (0.46) | MEN1KMT2ARAB9ANPC1PLAU | |
| SCHEMBL7655328 | 0.77 | MAPT (0.48) | MEN1KMT2ASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL7649708 | 0.77 | KMT2A (0.41) | MEN1KMT2ARAB9ANPC1PLAU | |
| SCHEMBL6299417 | 0.76 | ROCK2 (0.59) | MEN1KMT2ARAB9ASMN1; SMN2MAPT | |
| SCHEMBL7653872 | 0.75 | ROCK2 (0.38) | RAB9ANPC1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7660601 | 0.72 | MAPT (0.44) | MEN1KMT2ARAB9ANPC1PLAU | |
| Hydrochloric Acid SCHEMBL7653098 | 0.72 | MAPT (0.43) | MEN1KMT2ARAB9ANPC1PLAU | |
| SCHEMBL7012972 | 0.71 | KMT2A (0.43) | MEN1KMT2ARAB9ANPC1PLAU |
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 |
|---|---|---|---|---|---|---|---|
| US-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | claimed |
| US-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | disclosed |