Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL13328091 | 0.94 | CA1 (0.41) | CA1CA2CA12CA7CA9 | |
| SCHEMBL29106079 | 0.85 | LDHA (0.63) | CA1CA2CA12CA7CA9 | |
| SCHEMBL13360245 | 0.82 | LDHA (0.46) | CA1CA2CA12CA7CA9 | |
| SCHEMBL23854026 | 0.82 | CA1 (0.45) | CA1CA2CA12CA7CA9 | |
| SCHEMBL13328090 | 0.81 | LDHA (0.48) | ALDH1A1KDM4EHPGDKMT2AALOX15 | |
| SCHEMBL13108496 | 0.80 | DHODH (0.49) | CA1CA2CA12ALDH1A1KDM4E | |
| SCHEMBL9318569 | 0.80 | KDM4E (0.62) | CA1CA2CA12CA7CA9 | |
| SCHEMBL7018427 | 0.78 | CSNK2A1 (0.48) | CA1CA2CA12CA7CA9 | |
| SCHEMBL20855918 | 0.78 | CA1 (0.48) | CA1CA2CA12CA7CA9 | |
| SCHEMBL21246826 | 0.78 | CA1 (0.42) | 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 |
|---|---|---|---|---|---|---|---|
| US-7718803-B2 | Self-dispersible bipyridine-based metal complex and ink composition comprising the same | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2010-05-18 | — | — | US | disclosed |