Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15543475 | 0.87 | NOTUM (0.53) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL29430676 | 0.87 | NOTUM (0.53) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL24619902 | 0.83 | CA12 (0.41) | NOTUMCA1CA2CA12CA9 | |
| SCHEMBL31430582 | 0.82 | CA1 (0.61) | CA1CA2CA12CA7CA9 | |
| SCHEMBL2502725 | 0.82 | SLC6A3 (0.48) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL19899909 | 0.81 | KDM4E (0.54) | CA1CA2CA12CA7CA9 | |
| SCHEMBL31435251 | 0.81 | SLC6A3 (0.47) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL2505147 | 0.80 | CA12 (0.42) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL31056715 | 0.80 | NPC1 (0.47) | NOTUMCA1CA2CA12CA7 | |
| SCHEMBL24619897 | 0.80 | CREBBP (0.43) | CA1CA2CA12CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104870422-B | Amine derivative or its salt | 富士胶片富山化学株式会社 | 2019-03-15 | — | — | CN | disclosed |