Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8029708 | 0.88 | CYP2A6 (0.38) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8033368 | 0.88 | CYP2A6 (0.38) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8031487 | 0.88 | CYP2A6 (0.38) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8029707 | 0.88 | CYP2A6 (0.38) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8832798 | 0.84 | CYP2A6 (0.35) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8029658 | 0.84 | CYP1A2 (0.44) | CYP2A6TSHRCYP1A2ALDH1A1MAPT | |
| SCHEMBL8061426 | 0.83 | MAPT (0.34) | CYP2A6TSHRALDH1A1MAPTHTR2A | |
| SCHEMBL8056374 | 0.82 | MAPT (0.33) | CYP2A6TSHRALDH1A1MAPTHTR2A | |
| SCHEMBL8055047 | 0.81 | CYP2A6 (0.33) | CYP2A6TSHRCYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL7777414 | 0.80 | CYP2A6 (0.47) | CYP2A6TSHRCYP1A2ALDH1A1MAPT |
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-0695756-B1 | Process for the preparation of compounds of the phosphane series as well as their use | CELANESE CHEM EUROPE GMBH (DE) | 2000-03-15 | — | — | EP | disclosed |
| US-5728886-A | Compounds of the phosphine group, their preparation and their use | HOECHST AG (DE) | 1998-03-17 | — | — | US | disclosed |
| EP-0695756-A1 | Compounds of the phosphane series, process for their preparation as well as their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-02-07 | — | — | EP | disclosed |