Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | STAT1 | P42224 | 1/20 | 0.47 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.47 |
| ▸ | PSMD11 | O00231 | 1/20 | 0.47 |
| ▸ | PSMD12 | O00232 | 1/20 | 0.47 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7472207 | 0.86 | NQO2 (0.58) | NQO2ALDH1A1CYP1A2HSD17B10RAB9A | |
| SCHEMBL8528282 | 0.84 | SMN1; SMN2 (0.58) | ALDH1A1HSD17B10RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL8532084 | 0.82 | MAPT (0.45) | NQO2ALDH1A1CYP1A2HSD17B10RAB9A | |
| SCHEMBL9739530 | 0.80 | KDM4E (0.48) | ALDH1A1CYP1A2HSD17B10RAB9ANPC1 | |
| SCHEMBL10815305 | 0.79 | CA1 (0.45) | ALDH1A1HSD17B10RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL8531316 | 0.79 | POLB (0.50) | ALDH1A1HSD17B10SMN1; SMN2MAPTPOLB | |
| SCHEMBL8532212 | 0.78 | SMN1; SMN2 (0.46) | ALDH1A1CYP1A2RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL694904 | 0.78 | NQO2 (0.56) | NQO2ALDH1A1CYP1A2HSD17B10RAB9A | |
| SCHEMBL8531965 | 0.77 | HSP90AA1 (0.50) | NQO2ALDH1A1HSD17B10RAB9ANPC1 | |
| SCHEMBL3786463 | 0.76 | NQO2 (0.73) | NQO2ALDH1A1CYP1A2HSD17B10RAB9A |
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-5227475-A | WATER-SOLUBLE FIBER-REACTIVE DYESTUFFS CONTAINING A CYANAMIDO-SUBSTITUTED TRIAZINYLAMINO-GROUPING, AND A PROCESS FOR DYEING WITH THE USE OF THESE DYES | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-07-13 | — | — | US | disclosed |