Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MGLL | Q99685 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18860819 | 0.83 | TDP1 (0.50) | TDP1ALDH1A1GLATP53TSHR | |
| SCHEMBL21873603 | 0.78 | TMEM97 (0.46) | TDP1ALDH1A1TP53CYP3A4SMN1; SMN2 | |
| SCHEMBL28687474 | 0.74 | TDP1 (0.31) | TDP1 | |
| SCHEMBL18170156 | 0.73 | TSHR (0.34) | TSHR | |
| Biphenyl SCHEMBL23045578 | 0.71 | TDP1 (0.59) | TDP1ALDH1A1GLATP53TSHR | |
| SCHEMBL17028904 | 0.71 | TDP1 (1.00) | TDP1ALDH1A1GLATP53TSHR | |
| SCHEMBL31220 | 0.71 | TDP1 (1.00) | TDP1ALDH1A1GLATP53TSHR | |
| Biphenyl SCHEMBL93293 | 0.71 | TDP1 (0.59) | TDP1ALDH1A1GLATP53TSHR | |
| SCHEMBL1582872 | 0.71 | TDP1 (1.00) | TDP1ALDH1A1GLATP53TSHR | |
| SCHEMBL1583161 | 0.71 | TDP1 (1.00) | TDP1ALDH1A1GLATP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-104870435-B | Aryl and heteroaryl-condensed lactams | 辉瑞大药厂 | 2016-12-07 | — | — | CN | disclosed |
| CN-104662021-B | Novel bicyclic pyridinones | 辉瑞大药厂 | 2016-08-24 | — | — | CN | disclosed |
| CN-104870435-A | Aryl and heteroaryl fused lactams | PFIZER | 2015-08-26 | — | — | CN | disclosed |