Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.46 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ME2 | P23368 | 1/20 | 0.40 |
| ▸ | ME1 | P48163 | 1/20 | 0.40 |
| ▸ | ME3 | Q16798 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8604209 | 0.78 | EGFR (0.44) | CYP3A4ALDH1A1CYP1A2ME2ME1 | |
| SCHEMBL8604085 | 0.72 | CNR1 (0.39) | NQO2ALDH1A1ME2ME1ME3 | |
| SCHEMBL30353206 | 0.70 | KDM4E (0.64) | MTNR1AMTNR1BNQO2ALDH1A1CYP1A2 | |
| SCHEMBL21712157 | 0.69 | MTNR1A (0.52) | MTNR1AMTNR1BNQO2CYP3A4ALDH1A1 | |
| SCHEMBL3210719 | 0.69 | ALDH1A1 (0.56) | MTNR1AMTNR1BNQO2CYP3A4ALDH1A1 | |
| SCHEMBL6095610 | 0.68 | ALDH1A1 (0.47) | MTNR1AMTNR1BNQO2CYP3A4ALDH1A1 | |
| SCHEMBL8578397 | 0.68 | MTNR1A (0.63) | MTNR1AMTNR1BNQO2ALDH1A1KDM4E | |
| SCHEMBL7291800 | 0.67 | NQO2 (0.50) | MTNR1AMTNR1BNQO2CYP3A4ALDH1A1 | |
| SCHEMBL5822130 | 0.66 | ALDH1A1 (0.73) | CYP3A4ALDH1A1CYP1A2ELANEUSP2 | |
| SCHEMBL6096465 | 0.65 | KDR (0.50) | MTNR1AMTNR1BCYP3A4ALDH1A1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5786488-A | DEHYDROBROMINATION OF A DIBROMOBENZOQUINONES WITH AT LEAST ONE INDOLES IN A POLAR SOLVENT AND A METAL CARBONATE TO FORM AN ANTITUMOR AGENT | SUGEN, INC. (US) | 1998-07-28 | — | — | US | disclosed |
| US-5780496-A | Method and compositions for inhibition of adaptor protein/tyrosine kinase interactions | SUGEN, INC. (US) | 1998-07-14 | — | — | US | disclosed |