Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CCR4 | P51679 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28040528 | 0.89 | PPARG (0.34) | ALDH1A1HTTLMNAMAPTKDM4E | |
| Quinoline SCHEMBL28819048 | 0.80 | ALDH1A1 (0.44) | ALDH1A1HTTALOX15SMN1; SMN2LMNA | |
| Quinoline SCHEMBL28040034 | 0.80 | ALDH1A1 (0.39) | ALDH1A1HTTSMN1; SMN2LMNANPSR1 | |
| SCHEMBL28040031 | 0.77 | PPARA (0.40) | ALDH1A1SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL28040533 | 0.75 | KMT2A (0.47) | ALDH1A1SMN1; SMN2LMNAMAPTRAB9A | |
| Quinoline SCHEMBL28013256 | 0.74 | ALDH1A1 (0.52) | ALDH1A1HTTALOX15SMN1; SMN2LMNA | |
| SCHEMBL28040727 | 0.73 | SMN1; SMN2 (0.36) | ALDH1A1HTTSMN1; SMN2MAPTNPC1 | |
| Quinoline SCHEMBL28013837 | 0.73 | ALDH1A1 (0.41) | ALDH1A1HTTALOX15SMN1; SMN2LMNA | |
| Quinoline SCHEMBL28013231 | 0.72 | ALDH1A1 (0.61) | ALDH1A1HTTALOX15SMN1; SMN2MAPT | |
| Quinoline SCHEMBL28013230 | 0.70 | ALDH1A1 (0.46) | ALDH1A1HTTALOX15SMN1; SMN2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105175392-B | A kind of carboxylic acid compound containing thiophene-structure and amide compound containing thiophene-structure and preparation method thereof | 湖南大学 | 2019-04-19 | — | — | CN | disclosed |
| CN-105175392-A | Carboxylic acid compounds containing thiophene structures and amide compounds containing thiophene structures and preparation method for carboxylic acid compounds and amide compounds | UNIV HUNAN | 2015-12-23 | — | — | CN | disclosed |