Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ME2 | P23368 | 1/20 | 0.39 |
| ▸ | ME1 | P48163 | 1/20 | 0.39 |
| ▸ | ME3 | Q16798 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | RET | P07949 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182648 | 0.74 | CNR1 (0.48) | CNR1CNR2CYP19A1NQO2KDM4E | |
| SCHEMBL8604971 | 0.72 | MTNR1A (0.46) | ME2ME1ME3CYP19A1NQO2 | |
| SCHEMBL8604209 | 0.72 | EGFR (0.44) | ME2ME1ME3KDM4EALDH1A1 | |
| SCHEMBL7257608 | 0.70 | RET (0.44) | CNR1CNR2CYP19A1NQO2KDM4E | |
| SCHEMBL2430302 | 0.69 | ALDH1A1 (0.46) | CNR1CNR2KDM4EALDH1A1MEN1 | |
| SCHEMBL6095610 | 0.68 | ALDH1A1 (0.47) | CNR2NQO2KDM4EALDH1A1HPGD | |
| SCHEMBL6096141 | 0.68 | HTR2A (0.44) | ALDH1A1MEN1KMT2AMAPTGSK3B | |
| SCHEMBL7261266 | 0.68 | ALDH1A1 (0.46) | CYP19A1KDM4EALDH1A1HPGDRET | |
| SCHEMBL10839866 | 0.68 | KDM4E (0.65) | CNR1CNR2CYP19A1NQO2KDM4E | |
| SCHEMBL7837750 | 0.66 | ALDH1A1 (0.45) | CNR1CNR2CYP19A1NQO2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5780496-A | Method and compositions for inhibition of adaptor protein/tyrosine kinase interactions | SUGEN, INC. (US) | 1998-07-14 | — | — | US | claimed |
| 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 |