Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.61 |
| ▸ | RAB9A | P51151 | 7/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | MEN1 | O00255 | 4/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 4/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13111270 | 0.88 | NPC1 (0.60) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL11585179 | 0.86 | HTT (0.68) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL11583141 | 0.83 | KMT2A (0.52) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL13111269 | 0.81 | RAB9A (0.60) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL11583174 | 0.81 | MAPT (0.55) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL29031737 | 0.81 | NPC1 (0.68) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL8665984 | 0.80 | NPC1 (0.63) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL9116412 | 0.80 | NPC1 (0.56) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL11582850 | 0.80 | CA12 (0.56) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL25374780 | 0.79 | TSHR (0.48) | NPC1RAB9AKMT2AMEN1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4111936-A | PYRIDAZINETHIONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1978-09-05 | — | — | US | disclosed |