Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.63 |
| ▸ | RAB9A | P51151 | 8/20 | 0.63 |
| ▸ | HPGD | P15428 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | TAS2R38 | P59533 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 5/20 | 0.48 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 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 | |
|---|---|---|---|---|
| SCHEMBL9317189 | 0.94 | NPC1 (0.70) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| SCHEMBL557621 | 0.91 | NPC1 (0.73) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| SCHEMBL9317188 | 0.89 | NPC1 (0.70) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| SCHEMBL10978008 | 0.87 | NPC1 (0.71) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| Acetic Acid SCHEMBL9318268 | 0.84 | NPC1 (0.65) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| N-Phenylbenzamide SCHEMBL25189486 | 0.80 | SIRT1 (0.67) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| Benzoic Acid SCHEMBL9317246 | 0.80 | ALDH1A1 (0.65) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| Acetic Acid SCHEMBL9317237 | 0.80 | NPC1 (0.65) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| SCHEMBL10382103 | 0.79 | GAA (0.64) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 | |
| SCHEMBL27367006 | 0.79 | NPC1 (0.69) | NPC1RAB9AHPGDKMT2ASMN1; SMN2 |
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-5354514-A | Heating mixture of thioamide compound and copper- or lead-containing compound | JUJO PAPER CO., LTD. (JP) | 1994-10-11 | — | — | US | disclosed |