Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.64 |
| ▸ | RAB9A | P51151 | 5/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.64 |
| ▸ | RELA | Q04206 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HAVCR2 | Q8TDQ0 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7958685 | 0.87 | NR1H4 (0.62) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL4875581 | 0.83 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL7963733 | 0.82 | HTR7 (0.54) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL15028190 | 0.82 | GRM5 (0.68) | NPC1RAB9ASMN1; SMN2TP53S1PR1 | |
| SCHEMBL29904793 | 0.79 | CHRNB2 (0.63) | SMN1; SMN2KDM4EALDH1A1LMNACHRNB2 | |
| Irampanel SCHEMBL678128 | 0.79 | HTR7 (0.63) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL7957012 | 0.78 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL7956779 | 0.78 | HTR7 (0.52) | NPC1RAB9ASMN1; SMN2TP53S1PR1 | |
| SCHEMBL7947861 | 0.78 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2TP53NFKB1 | |
| SCHEMBL6328183 | 0.78 | FFAR1 (0.58) | TP53MEN1KMT2AMAPTKDM4E |
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-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |