Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4070631 | 0.81 | CA12 (0.46) | CA12CA14CA2ALDH1A1LMNA | |
| SCHEMBL28975583 | 0.76 | LMNA (0.43) | ALDH1A1GAAKDM4ELMNAHSD17B10 | |
| SCHEMBL17822705 | 0.74 | ALDH1A1 (0.54) | CA12CA14CA2ALDH1A1LMNA | |
| SCHEMBL15380870 | 0.74 | CA12 (0.42) | CA12CA2CA9CA1 | |
| SCHEMBL31120884 | 0.74 | ALDH1A1 (0.32) | ALDH1A1NPC1TSHR | |
| SCHEMBL8930152 | 0.73 | CA12 (0.48) | CA12CA14CA2ALDH1A1GAA | |
| SCHEMBL2583703 | 0.73 | CA12 (0.48) | CA12CA14CA2ALDH1A1GAA | |
| SCHEMBL27446659 | 0.72 | — | — | |
| SCHEMBL17652399 | 0.72 | ALDH1A1 (0.39) | CA12CA14CA2ALDH1A1GAA | |
| SCHEMBL7840740 | 0.71 | CA12 (0.52) | CA12CA14CA2ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0851770-A2 | BIFUNCTIONAL SULPHIDE-CONTAINING SULPHONAMIDE S 2?NY-TYPE CHELATE-FORMING AGENTS FOR RADIOISOTOPES | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) | 1998-07-08 | — | — | EP | disclosed |
| WO-1997012636-A2 | BIFUNCTIONAL SULPHIDE-CONTAINING SULPHONAMIDE S2NY-TYPE CHELATE-FORMING AGENTS FOR RADIOISOTOPES | Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) | 1997-04-10 | — | — | WO | disclosed |