Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 8/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GRM8 | O00222 | 2/20 | 0.33 |
| ▸ | GRM6 | O15303 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28099479 | 0.83 | TSHR (0.42) | NSD2GRM4CYP1A2CYP2C19ALDH1A1 | |
| 1-Aminocyclopropane Carboxylic Acid SCHEMBL21462059 | 0.74 | NSD2 (0.63) | NSD2GRM4CYP1A2CYP2C19ALDH1A1 | |
| 1-Aminocyclopropane Carboxylic Acid SCHEMBL61082 | 0.74 | — | — | |
| SCHEMBL31348874 | 0.74 | NSD2 (0.63) | NSD2GRM4CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL12230939 | 0.74 | — | — | |
| SCHEMBL413223 | 0.74 | — | — | |
| 1-Aminocyclopropane Carboxylic Acid SCHEMBL3967053 | 0.74 | — | — | |
| SCHEMBL8024568 | 0.72 | — | — | |
| 1-Aminocyclopropane Carboxylic Acid SCHEMBL8881129 | 0.72 | — | — | |
| 1-Aminocyclopropane Carboxylic Acid SCHEMBL20515161 | 0.72 | NSD2 (0.60) | NSD2GRM4CYP1A2CYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101479274-A | Pharmaceutical compounds | HOFFMANN LA ROCHE (CH) | 2009-07-08 | — | — | CN | claimed |