Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | SCN4A | P35499 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1582351 | 0.83 | MEN1 (0.39) | ACHETSHRCYP3A4TDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28407256 | 0.82 | MEN1 (0.38) | ACHETSHRCYP3A4TDP1ALDH1A1 | |
| Water SCHEMBL27748223 | 0.82 | MEN1 (0.38) | ACHETSHRCYP3A4TDP1ALDH1A1 | |
| SCHEMBL6678983 | 0.78 | TAAR1 (0.43) | ACHETSHRCYP3A4TDP1ALDH1A1 | |
| SCHEMBL14050273 | 0.74 | CA1 (0.44) | TSHRCYP3A4TDP1ALDH1A1CA1 | |
| SCHEMBL29126122 | 0.74 | ESR1 (0.35) | CYP3A4TDP1MAPTHTTSMN1; SMN2 | |
| SCHEMBL29083581 | 0.74 | PDCD1 (0.35) | TSHRCYP3A4TDP1 | |
| SCHEMBL8029937 | 0.72 | FFAR1 (0.38) | ACHETSHRCYP3A4TDP1ALDH1A1 | |
| SCHEMBL20906761 | 0.71 | KDM4E (0.31) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL20906372 | 0.70 | ATP4A (0.34) | ALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2295505-B1 | Ink composition, ink set and image forming method | FUJIFILM CORP (JP) | 2017-09-27 | — | — | EP | disclosed |