Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 9/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.56 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 5/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HPSE | Q9Y251 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7653757 | 0.99 | MAPT (0.55) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| SCHEMBL7660806 | 0.90 | MAPT (0.55) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| SCHEMBL7651394 | 0.87 | MAPT (0.53) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| Hydrochloric Acid SCHEMBL7659633 | 0.87 | MAPT (0.52) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| SCHEMBL7657907 | 0.87 | MAPT (0.63) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| SCHEMBL7654982 | 0.86 | SMN1; SMN2 (0.40) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| Hydrochloric Acid SCHEMBL7659619 | 0.85 | SMN1; SMN2 (0.39) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 | |
| SCHEMBL7653638 | 0.79 | BRAF (0.47) | MAPTSMN1; SMN2MEN1KMT2ATP53 | |
| Hydrochloric Acid SCHEMBL7662250 | 0.78 | BRAF (0.46) | MAPTSMN1; SMN2MEN1KMT2ATP53 | |
| SCHEMBL7655308 | 0.76 | MAPT (0.39) | MAPTSMN1; SMN2HSD17B10ALOX15ALOX12 |
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 |