Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.72 |
| ▸ | BLM | P54132 | 2/20 | 0.72 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | EBP | Q15125 | 1/20 | 0.57 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.56 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | NPY1R | P25929 | 1/20 | 0.55 |
| ▸ | NPY2R | P49146 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8734889 | 0.99 | KDM4E (0.70) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL19194551 | 0.84 | KDM4E (0.59) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL20079681 | 0.84 | KDM4E (0.61) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL10118317 | 0.83 | CYP1A2 (0.79) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL12296058 | 0.82 | BCHE (0.61) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL2742565 | 0.82 | KDM4E (0.68) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| Hydrochloric Acid SCHEMBL17821823 | 0.81 | KDM4E (0.66) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL8554822 | 0.80 | MAPK1 (0.64) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL30472718 | 0.80 | ABCB1 (0.59) | KDM4ECYP1A2CYP3A4CYP2D6BLM | |
| SCHEMBL9416643 | 0.80 | KDM4E (0.81) | KDM4ECYP1A2CYP3A4CYP2D6BLM |
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-0641766-B1 | ALKOXYPHENYLALKYLAMINE DERIVATIVE | TAISHO PHARMACEUTICAL CO LTD (JP) | 1998-11-11 | — | — | EP | disclosed |
| US-5495046-A | PSYCHOLOGICAL DISORDERS | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 1996-02-27 | — | — | US | disclosed |
| EP-0641766-A1 | ALKOXYPHENYLALKYLAMINE DERIVATIVE | TAISHO PHARMACEUTICAL CO. LTD (JP) | 1995-03-08 | — | — | EP | disclosed |