Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7292415 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL10896772 | 0.83 | TRPA1 (0.35) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL2313488 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL29373824 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL1276606 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL308354 | 0.79 | ALDH1A1 (0.38) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL12426100 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL11051471 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL19661446 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A | |
| SCHEMBL2094988 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TSHRKDM4ERAB9AAPOBEC3A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104066724-A | P2X4 receptor antagonists | NIPPON CHEMIPHAR CO | 2014-09-24 | — | — | CN | disclosed |
| CN-1102527-A | Piperazinocarbonylcarbostyrils as peripheral vasodilators | OTSUKA PHARMA CO LTD (JP) | 1995-05-10 | — | — | CN | disclosed |
| US-5260330-A | Antiarrhythmia agent | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-09 | — | — | US | disclosed |
| US-5068325-A | Dopaminergic systems as hypotensives, sedatives, antitussives and/or antiphlogistics | KARL THOMAE GMBH (DE) | 1991-11-26 | — | — | US | disclosed |