Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11435164 | 0.93 | ALDH1A1 (0.34) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL11435165 | 0.93 | ALDH1A1 (0.34) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL8889010 | 0.85 | FAAH (0.42) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL7101386 | 0.79 | CA2 (0.47) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL7101381 | 0.79 | CA2 (0.47) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL1447691 | 0.79 | ALDH1A1 (0.39) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL8888587 | 0.79 | TSHR (0.38) | ALDH1A1TDP1CYP3A4TSHRCA2 | |
| SCHEMBL2004755 | 0.78 | — | — | |
| SCHEMBL2004753 | 0.78 | — | — | |
| SCHEMBL8333704 | 0.76 | — | — |
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-1337536-A1 | CATIONIC GROUP-3 CATALYST SYSTEM | ExxonMobil Chemical Patents Inc. (US) | 2003-08-27 | — | — | EP | disclosed |
| WO-2002032909-A1 | CATIONIC GROUP-3 CATALYST SYSTEM | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2002-04-25 | — | — | WO | disclosed |