Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL30911299 | 0.85 | TSHR (0.46) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL466030 | 0.81 | ALDH1A1 (0.49) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL151791 | 0.81 | ALDH1A1 (0.49) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL28206057 | 0.80 | ALDH1A1 (0.47) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL28578731 | 0.80 | ALDH1A1 (0.40) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL15942168 | 0.80 | TSHR (0.41) | TSHRCYP2C19ALDH1A1TDP1POLB | |
| SCHEMBL15567587 | 0.79 | TSHR (0.44) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL8074231 | 0.79 | TSHR (0.44) | TSHRCYP2C19ALDH1A1ATMKDM4E | |
| SCHEMBL5727501 | 0.75 | CYP2C9 (0.46) | ALDH1A1LMNA | |
| SCHEMBL10705265 | 0.75 | CYP2C9 (0.46) | ALDH1A1LMNA |
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-0795596-B1 | Fuel compositions | SHELL INT RESEARCH (NL) | 2000-10-11 | — | — | EP | disclosed |
| EP-0795596-A1 | Fuel compositions | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1997-09-17 | — | — | EP | disclosed |