Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27889607 | 0.95 | ALDH1A1 (0.48) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| SCHEMBL60813 | 0.95 | — | — | |
| SCHEMBL28496089 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| Ammonia Solution, Strong SCHEMBL5963098 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| Ethane SCHEMBL28099105 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| SCHEMBL25271339 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| Methyl Alcohol SCHEMBL28596826 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| SCHEMBL28056455 | 0.92 | ALDH1A1 (0.46) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| Alcohol SCHEMBL28293887 | 0.90 | PKM (0.45) | ALDH1A1POLBNPSR1LMNAHSD17B10 | |
| Bicarbonate SCHEMBL23827515 | 0.90 | ALDH1A1 (0.43) | ALDH1A1POLBNPSR1LMNAHSD17B10 |
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-107108599-A | Trifluoromethanols as Ror gamma t modulators | 詹森药业有限公司 | 2017-08-29 | — | — | CN | disclosed |