Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ATP4A | P20648 | 1/20 | 0.33 |
| ▸ | ATP4B | P51164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL29443967 | 0.83 | CYP3A4 (0.43) | CYP3A4TSHRPIK3CATDP1TAAR1 | |
| SCHEMBL43944 | 0.83 | CYP3A4 (0.43) | CYP3A4TSHRPIK3CATDP1TAAR1 | |
| Hydrochloric Acid SCHEMBL9834388 | 0.81 | CYP3A4 (0.42) | CYP3A4TDP1TAAR1SIGMAR1ALDH1A1 | |
| Dimethylamine SCHEMBL11264463 | 0.77 | SIGMAR1 (0.39) | CYP3A4TDP1TAAR1SIGMAR1ALDH1A1 | |
| SCHEMBL9174323 | 0.75 | CYP3A4 (0.42) | CYP3A4TSHRPIK3CATDP1TAAR1 | |
| SCHEMBL8942955 | 0.74 | ALDH1A1 (0.41) | CYP3A4TSHRTDP1TAAR1ALDH1A1 | |
| Catechol SCHEMBL11031358 | 0.74 | TSHR (0.48) | CYP3A4TSHRPIK3CATDP1TAAR1 | |
| SCHEMBL33509 | 0.74 | CYP3A4 (0.50) | CYP3A4TSHRPIK3CATDP1ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL28700970 | 0.74 | SKP2 (0.37) | CYP3A4TSHRPIK3CATDP1SKP2 | |
| Alcohol SCHEMBL239141 | 0.73 | CYP3A4 (0.40) | CYP3A4TSHRPIK3CATDP1SKP2 |
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-1628160-A2 | Resist composition and patterning process | Shin-Etsu Chemical Co., Ltd. (JP) | 2006-02-22 | — | — | EP | disclosed |