Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL27804631 | 0.94 | TP53 (0.61) | TP53ALDH1A1PPARGPPARAKDM4E | |
| Ethylbenzene SCHEMBL6207218 | 0.83 | TP53 (0.78) | TP53ALDH1A1PPARGPPARATDP1 | |
| Phenylethyl Alcohol SCHEMBL27472539 | 0.82 | TDP1 (0.64) | ALDH1A1PPARAKDM4ELMNATDP1 | |
| Benzyl Alcohol SCHEMBL5039741 | 0.82 | TSHR (0.61) | ALDH1A1PPARGPPARAKDM4ELMNA | |
| Biphenyl SCHEMBL28832981 | 0.82 | SMN1; SMN2 (0.48) | TP53ALDH1A1KDM4ELMNASMN1; SMN2 | |
| Ethylbenzene SCHEMBL28077388 | 0.82 | TP53 (0.61) | TP53ALDH1A1PPARGPPARAKDM4E | |
| Methacrylic Acid SCHEMBL1088569 | 0.81 | TSHR (0.54) | ALDH1A1KDM4ELMNATDP1SMN1; SMN2 | |
| Ethylbenzene SCHEMBL10979046 | 0.81 | TP53 (0.74) | TP53ALDH1A1PPARGPPARALMNA | |
| Ethylbenzene SCHEMBL28754507 | 0.81 | TP53 (0.74) | TP53ALDH1A1PPARGPPARALMNA | |
| Ethylbenzene SCHEMBL27596106 | 0.81 | TP53 (0.74) | TP53ALDH1A1PPARGPPARALMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1506239-A2 | SURFACE GRAFT MODIFIED RESINS AND FORMATION THEREOF | Phenomenex, Inc. (US) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003064478-A2 | SURFACE GRAFT MODIFIED RESINS AND FORMATION THEREOF | PHENOMENEX, INC. (US) | 2003-08-07 | — | — | WO | disclosed |