Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | WRN | Q14191 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9276 | 0.93 | — | — | |
| SCHEMBL7152292 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| Propane SCHEMBL20562580 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL29230050 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL7167555 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL2128603 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL9350570 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL7631690 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL8337141 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR | |
| SCHEMBL27466132 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TDP1FFAR3NAAATSHR |
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-5710328-A | DEHYDROGENATION | EASTMAN CHEMICAL COMPANY (US) | 1998-01-20 | — | — | US | disclosed |