Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 12/20 | 0.34 |
| ▸ | CA2 | P00918 | 12/20 | 0.34 |
| ▸ | CA4 | P22748 | 7/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7775741 | 0.81 | TDP1 (0.50) | CA1CA2CA4CA12CA9 | |
| SCHEMBL8537359 | 0.81 | TDP1 (0.50) | CA1CA2CA4CA12CA9 | |
| SCHEMBL7778729 | 0.79 | TDP1 (0.48) | CA1CA2CA4CA12CA9 | |
| SCHEMBL11007132 | 0.77 | — | — | |
| SCHEMBL8534220 | 0.74 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL9751759 | 0.73 | TDP1 (0.40) | CA1CA2CA4CA12CA9 | |
| Bicarbonate SCHEMBL9507150 | 0.72 | TDP1 (0.39) | CA1CA2CA4CA12CA9 | |
| SCHEMBL27092866 | 0.71 | TDP1 (0.46) | CA2CA4TDP1KDM4ELMNA | |
| SCHEMBL27092877 | 0.71 | TDP1 (0.46) | CA2CA4TDP1KDM4ELMNA | |
| SCHEMBL8841052 | 0.70 | TDP1 (0.38) | CA1CA2CA4CA12CA9 |
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-5679810-A | AMIDE OR ESTER LINKAGES; COMPLEXES PARAMAGNETIC METAL IONS; DIAGNOSTIC IMAGING | SALUTAR, INC. (US) | 1997-10-21 | — | — | US | disclosed |