Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 13/20 | 0.78 |
| ▸ | RAB9A | P51151 | 12/20 | 0.78 |
| ▸ | SMN1; SMN2 | Q16637 | 11/20 | 0.78 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.78 |
| ▸ | STAT1 | P42224 | 1/20 | 0.69 |
| ▸ | MITF | O75030 | 1/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | APEX1 | P27695 | 1/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | ACP1 | P24666 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.60 |
| ▸ | TP53 | P04637 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.60 |
| ▸ | RELA | Q04206 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | ALPL | P05186 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL5342626 | 0.92 | NPC1 (0.78) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL5355152 | 0.88 | NPC1 (0.73) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL5352428 | 0.86 | RAB9A (0.67) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL11303998 | 0.84 | NPC1 (0.80) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL6057541 | 0.82 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL18585932 | 0.80 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL14808429 | 0.79 | SMN1; SMN2 (0.77) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL4746072 | 0.79 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL6058397 | 0.78 | SMN1; SMN2 (0.71) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 | |
| SCHEMBL29973978 | 0.78 | NPC1 (0.74) | NPC1RAB9ASMN1; SMN2KDM4ESTAT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007113644-A2 | NEW HDAC INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-10-11 | — | — | WO | disclosed |
| WO-2007113644-A2 | NEW HDAC INHIBITORS | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-10-11 | — | — | WO | disclosed |