Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL9493067 | 0.83 | CYP1A2 (0.43) | ALDH1A1TAAR1HTR2CHTR2BMEN1 | |
| SCHEMBL858731 | 0.77 | CYP11B1 (0.40) | ALDH1A1TAAR1MEN1KMT2ACYP1A2 | |
| SCHEMBL5410799 | 0.73 | AR (0.41) | TDP1ALDH1A1TAAR1MEN1KMT2A | |
| SCHEMBL30951651 | 0.73 | HRH3 (0.45) | TDP1ALDH1A1TAAR1L3MBTL1NPC1 | |
| SCHEMBL3301625 | 0.73 | TAAR1 (0.59) | ALDH1A1TAAR1L3MBTL1ARMPO | |
| SCHEMBL856298 | 0.71 | ALDH1A1 (0.40) | ALDH1A1TAAR1ADCY10KMT2AL3MBTL1 | |
| SCHEMBL17436168 | 0.70 | HDAC6 (0.43) | TDP1ALDH1A1TAAR1HTR2CHTR2B | |
| SCHEMBL1442670 | 0.70 | ADRB2 (0.45) | TDP1ALDH1A1KMT2AL3MBTL1NPC1 | |
| SCHEMBL11195639 | 0.70 | TAAR1 (0.50) | ALDH1A1TAAR1MEN1KMT2AL3MBTL1 | |
| SCHEMBL1442705 | 0.69 | L3MBTL1 (0.56) | TDP1ALDH1A1ADCY10MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010135568-A1 | BENZOXAZEPINES AS INHIBITORS OF MTOR AND THEIR USE TO TREAT CANCER | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |