Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SCD | O00767 | 1/20 | 0.47 |
| ▸ | ACP1 | P24666 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Benzamide SCHEMBL28281667 | 0.75 | RAB9A (0.55) | NPC1RAB9ALMNATSHRSCD | |
| Benzamide SCHEMBL28281665 | 0.73 | RAB9A (0.52) | NPC1RAB9ALMNASCDALDH1A1 | |
| Benzamide SCHEMBL2841981 | 0.73 | HSD17B10 (0.57) | NPC1RAB9ALMNATSHRSCD | |
| SCHEMBL1696327 | 0.72 | MAPK8 (0.52) | ALDH1A1AURKARPS6KB1 | |
| Benzamide SCHEMBL3177602 | 0.71 | PARP1 (0.55) | NPC1RAB9ALMNATSHRSCD | |
| SCHEMBL4238173 | 0.70 | NPC1 (0.65) | NPC1RAB9ALMNATSHRACP1 | |
| Benzamide SCHEMBL4367079 | 0.70 | HSD17B10 (0.53) | NPC1RAB9ALMNATSHRSCD | |
| SCHEMBL20577306 | 0.69 | TSHR (0.64) | NPC1RAB9ALMNATSHRACP1 | |
| 2-Phenylthiazole SCHEMBL5968560 | 0.69 | PDPK1 (0.68) | NPC1RAB9ATSHRALDH1A1MEN1 | |
| SCHEMBL4293350 | 0.69 | RAB9A (0.77) | NPC1RAB9ALMNASCDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109320473-A | Thiazoleamino benzamide acetogenin and application thereof | 南华大学 | 2019-02-12 | — | — | CN | disclosed |