Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | KDM6B | O15054 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.37 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CD74 | P04233 | 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 | |
|---|---|---|---|---|
| SCHEMBL28050875 | 0.92 | KMT2A (0.37) | KDM4EHPGDCYP1A2CYP2C9KMT2A | |
| Naphthalene SCHEMBL28011212 | 0.88 | KMT2A (0.43) | KDM4EHPGDHSD17B10KMT2ALMNA | |
| SCHEMBL28005920 | 0.88 | POLB (0.40) | CA12CA1CA2CA6CA9 | |
| SCHEMBL28012219 | 0.86 | POLB (0.41) | CA12CA1CA2CA6CA9 | |
| SCHEMBL28005995 | 0.84 | TSHR (0.40) | CA12CA1CA2CA6CA9 | |
| SCHEMBL17495602 | 0.84 | KMT2A (0.45) | KDM4EHPGDHSD17B10KMT2ALMNA | |
| SCHEMBL28054634 | 0.83 | TSHR (0.41) | CA12CA1CA2CA6CA9 | |
| SCHEMBL28451371 | 0.82 | PBRM1 (0.42) | CA1CA2CA9KDM4EKDM4C | |
| SCHEMBL28065967 | 0.81 | TSHR (0.40) | CA12CA1CA2CA6CA9 | |
| SCHEMBL28044876 | 0.81 | TSHR (0.40) | CA12CA1CA2CA6CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105503914-A | Triazole isophthalic acid cadmium complex single crystal and preparation method and application thereof | UNIV TIANJIN | 2016-04-20 | — | — | CN | disclosed |
| CN-105503914-A | Triazole isophthalic acid cadmium complex single crystal and preparation method and application thereof | UNIV TIANJIN | 2016-04-20 | — | — | CN | disclosed |