Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL18577902 | 0.89 | ESR1 (0.58) | CYP2A6ALDH1A1MAPTMEN1PKM | |
| SCHEMBL11695971 | 0.79 | CYP2A6 (0.44) | CYP2A6ALDH1A1MAPTMEN1PKM | |
| SCHEMBL10927078 | 0.79 | CYP2A6 (0.44) | CYP2A6ALDH1A1MAPTMEN1PKM | |
| SCHEMBL18508 | 0.73 | — | — | |
| SCHEMBL4258684 | 0.71 | CYP2A6 (0.50) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL3138002 | 0.69 | — | — | |
| SCHEMBL21518322 | 0.69 | — | — | |
| Methane SCHEMBL21489530 | 0.69 | CYP2A6 (0.89) | CYP2A6ALDH1A1MAPTALOX15MAPK1 | |
| Ammonia Solution, Strong SCHEMBL28776475 | 0.69 | — | — | |
| SCHEMBL9496102 | 0.69 | CYP2A6 (0.89) | CYP2A6ALDH1A1MAPTALOX15MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0113454-B1 | EXTRACTION OF SILVER AND PALLADIUM METALS FROM AQUEOUS SOLUTIONS USING TERTIARY PHOSPHINE SULFIDES | AMERICAN CYANAMID COMPANY (US) | 1987-02-04 | — | — | EP | disclosed |
| US-4623522-A | COMPLEXING | AMERICAN CYANAMID COMPANY (US) | 1986-11-18 | — | — | US | disclosed |
| EP-0113454-A2 | Extraction of silver and palladium metals from aqueous solutions using tertiary phosphine sulfides | AMERICAN CYANAMID COMPANY (US) | 1984-07-18 | — | — | EP | disclosed |