Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | PTPRC | P08575 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | TDP2 | O95551 | 1/20 | 0.48 |
| ▸ | NSD2 | O96028 | 1/20 | 0.48 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2970333 | 0.86 | NPC1 (0.50) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL864582 | 0.72 | NPC1 (0.77) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL5551699 | 0.72 | S100A4 (0.82) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL3135129 | 0.72 | NPC1 (0.86) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL516210 | 0.72 | NPC1 (0.86) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL30350052 | 0.72 | NPC1 (0.77) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL7915048 | 0.72 | PTPRC (0.82) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL9019051 | 0.72 | NPC1 (0.77) | NPC1ALDH1A1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL5510043 | 0.71 | MAOB (0.52) | GAAMAPTCA9CDK5 | |
| SCHEMBL3418531 | 0.71 | CASP3 (0.42) | TDP2 |
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-6605604-B1 | Tumour necrosis factor alpha release inhibitors; efficiency treatment of cancers, rheumatic diseases, arthritis, ulcers, atherosclerosis, asthma | LES LABORATOIRES SERVIER (FR) | 2003-08-12 | — | — | US | disclosed |