Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7225521 | 0.77 | ALDH1A1 (0.51) | LMNACYP2D6SRCMAPK1KMT2A | |
| SCHEMBL465593 | 0.77 | ALDH1A1 (0.51) | LMNACYP2D6SRCMAPK1KMT2A | |
| SCHEMBL27418681 | 0.75 | SRC (0.39) | LMNACYP2D6SRCMAPK1KMT2A | |
| SCHEMBL5923692 | 0.75 | HCAR2 (0.53) | HTTLMNACYP2D6SRCKMT2A | |
| SCHEMBL11791096 | 0.75 | ALDH1A1 (0.42) | HTTLMNACYP2D6SRCMAPK1 | |
| SCHEMBL11513632 | 0.73 | CTSK (0.41) | HTTKMT2ACYP3A4ALDH1A1 | |
| SCHEMBL11516703 | 0.72 | ELANE (0.39) | LMNACYP2D6KMT2ACYP3A4CYP1A2 | |
| SCHEMBL10780199 | 0.71 | TSHR (0.57) | MAPK1ALDH1A1CES2CES1CNR1 | |
| SCHEMBL5583368 | 0.70 | GSR (0.38) | HTTLMNACYP2D6SRCMAPK1 | |
| SCHEMBL11516799 | 0.69 | RIPK1 (0.37) | LMNACYP2D6KMT2ACYP1A2MEN1 |
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-4175185-A | ESTERIFICATION, IMINOHALOGENATION, ETHERIFICATION, HYDROLYSIS, DEESTERIFICATION | MEIJI SEIKA KAISHA LTD. (JP) | 1979-11-20 | — | — | US | disclosed |