Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.69 |
| ▸ | USP2 | O75604 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | BLM | P54132 | 1/20 | 0.69 |
| ▸ | SLC12A2 | P55011 | 1/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.69 |
| ▸ | AQP1 | P29972 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 16/20 | 0.58 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA3 | P07451 | 2/20 | 0.42 |
| ▸ | CA6 | P23280 | 2/20 | 0.42 |
| ▸ | CA5A | P35218 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11371169 | 0.91 | CA2 (0.68) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL11385637 | 0.91 | CA2 (0.68) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL11376533 | 0.89 | CA2 (0.72) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL21436432 | 0.89 | CA2 (0.63) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL21436524 | 0.88 | CA2 (0.70) | CA2KDM4EUSP2ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL11370731 | 0.88 | CA2 (0.70) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL574557 | 0.88 | CA2 (0.74) | CA2KDM4EUSP2ALDH1A1LMNA | |
| Water SCHEMBL11375400 | 0.88 | CA2 (0.62) | CA2KDM4EUSP2ALDH1A1LMNA | |
| SCHEMBL11371468 | 0.88 | CA2 (0.70) | CA2KDM4EUSP2ALDH1A1LMNA | |
| Bumetanide SCHEMBL251377 | 0.87 | CA2 (0.85) | CA2KDM4EUSP2ALDH1A1LMNA |
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-4247550-A | Compositions and methods for the treatment of hypertension or oedemas | LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) | 1981-01-27 | — | — | US | disclosed |