Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL19809342 | 0.85 | TSHR (0.44) | TP53ALDH1A1TSHRCYP1A2 | |
| Ethylbenzene SCHEMBL6889785 | 0.84 | TP53 (0.64) | TP53ALDH1A1PPARGPPARATSHR | |
| Biphenyl SCHEMBL28295625 | 0.82 | ALDH1A1 (0.43) | TP53ALDH1A1RAB9ASMN1; SMN2 | |
| Ethylbenzene SCHEMBL11223212 | 0.78 | TP53 (1.00) | TP53ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| Ethylbenzene SCHEMBL7458207 | 0.78 | TP53 (1.00) | TP53ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| Ethylbenzene SCHEMBL3987542 | 0.78 | TP53 (1.00) | TP53ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| Ethylbenzene SCHEMBL1330604 | 0.78 | — | — | |
| Ethylbenzene SCHEMBL1332452 | 0.78 | — | — | |
| Ethylbenzene SCHEMBL1331299 | 0.78 | — | — | |
| Ethylbenzene SCHEMBL27454352 | 0.78 | TP53 (1.00) | TP53ALDH1A1TSHRRAB9ASMN1; SMN2 |
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-0601496-B2 | Process for the preparation of olefin polymer | MITSUI CHEMICALS INC (JP) | 2001-06-27 | — | — | EP | disclosed |