Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 12/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.57 |
| ▸ | APAF1 | O14727 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ACHE | P22303 | 4/20 | 0.55 |
| ▸ | NMBR | P28336 | 3/20 | 0.54 |
| ▸ | GRPR | P30550 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7671985 | 0.89 | NMBR (0.65) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL7675962 | 0.82 | MMP2 (0.63) | KDM4EMAPTMEN1ALDH1A1CYP3A4 | |
| SCHEMBL7678243 | 0.81 | KDM4E (0.59) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL7678071 | 0.81 | KDM4E (0.67) | KDM4EMAPTMEN1ALDH1A1CYP3A4 | |
| SCHEMBL7671751 | 0.81 | NMBR (0.67) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL7675493 | 0.80 | SLC6A4 (0.58) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL7670517 | 0.80 | KDM4E (0.60) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL7848746 | 0.79 | KDM4E (0.52) | BCHEKDM4EMAPTMEN1ALDH1A1 | |
| SCHEMBL17017538 | 0.79 | POLB (0.69) | KDM4EMAPTMEN1ALDH1A1CYP3A4 | |
| SCHEMBL7672636 | 0.79 | KDM4E (0.65) | KDM4EMAPTMEN1ALDH1A1CYP3A4 |
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-6472418-B1 | Non-peptide NK1 receptors antagonists | WARNER-LAMBERT COMPANY | 2002-10-29 | — | — | US | disclosed |