Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.70 |
| ▸ | TGM2 | P21980 | 2/20 | 0.54 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.51 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 3/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5043916 | 0.82 | TGM2 (0.63) | ALDH1A1TGM2IMPDH2IMPDH1CYP1A2 | |
| SCHEMBL31606835 | 0.81 | TGM2 (0.54) | ALDH1A1TGM2EGFRERBB2 | |
| SCHEMBL12179325 | 0.78 | TGM2 (0.58) | ALDH1A1TGM2TP53PKMHPGD | |
| SCHEMBL9865437 | 0.78 | TGM2 (0.58) | ALDH1A1TGM2TP53PKMHPGD | |
| SCHEMBL30475564 | 0.78 | SMN1; SMN2 (0.72) | ALDH1A1TGM2TP53PKMHPGD | |
| SCHEMBL8983980 | 0.78 | ALDH1A1 (0.70) | ALDH1A1IMPDH2IMPDH1CYP1A2CYP2C19 | |
| SCHEMBL1381244 | 0.77 | TGM2 (0.59) | TGM2EGFRITK | |
| SCHEMBL9864914 | 0.77 | TGM2 (0.59) | ALDH1A1TGM2TP53PKMHPGD | |
| SCHEMBL21834411 | 0.75 | TGM2 (0.58) | ALDH1A1TGM2EGFRITKBRD4 | |
| SCHEMBL24968472 | 0.75 | EGFR (0.45) | ALDH1A1EGFRERBB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0409565-A1 | Rubber composition useful for tires | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-01-23 | — | — | EP | disclosed |