Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16953762 | 0.81 | ALDH1A1 (0.39) | ALDH1A1TDP1TLR8TSHRGPR35 | |
| SCHEMBL1855977 | 0.81 | MGMT (0.43) | LOXL2ALDH1A1TDP1TAAR1PNMT | |
| SCHEMBL14054978 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TDP1TLR8TSHRGPR35 | |
| SCHEMBL4146537 | 0.78 | PNMT (0.53) | LOXL2ALDH1A1TDP1TAAR1PNMT | |
| SCHEMBL4274301 | 0.78 | GPR35 (0.56) | LOXL2ALDH1A1TDP1TAAR1PNMT | |
| SCHEMBL28108699 | 0.78 | LOXL2 (0.41) | LOXL2ALDH1A1TDP1PNMTTSHR | |
| SCHEMBL25231628 | 0.75 | HMGB1 (0.47) | LOXL2ALDH1A1TDP1TSHRHPGD | |
| SCHEMBL194253 | 0.75 | TDP1 (0.49) | ALDH1A1TDP1TAAR1IDO1HPGD | |
| SCHEMBL28488606 | 0.75 | BID (0.40) | ALDH1A1TDP1KAT2B | |
| SCHEMBL30267557 | 0.75 | TDP1 (0.43) | ALDH1A1TDP1TLR8TSHRGPR35 |
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-2011012622-A1 | BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF GLYTL MEDIATED DISORDERS | GLAXO GROUP LIMITED (GB) | 2011-02-03 | — | — | WO | disclosed |