Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31423374 | 0.87 | TDP1 (0.45) | ARTDP1L3MBTL1CASP6ATM | |
| SCHEMBL15971307 | 0.87 | TDP1 (0.45) | ARTDP1L3MBTL1CASP6ATM | |
| SCHEMBL21749965 | 0.81 | TDP1 (0.51) | TDP1L3MBTL1CASP6ATMALDH1A1 | |
| SCHEMBL633629 | 0.80 | TDP1 (0.46) | TDP1L3MBTL1CASP6ATMALDH1A1 | |
| SCHEMBL8913169 | 0.79 | AR (0.38) | ARTDP1CASP6ATMALDH1A1 | |
| SCHEMBL10717546 | 0.79 | CES1 (0.38) | L3MBTL1ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL8772070 | 0.78 | AR (0.42) | ARTDP1CASP6ATMAKR1B1 | |
| SCHEMBL29154301 | 0.78 | TDP1 (0.45) | TDP1L3MBTL1CASP6ATMALDH1A1 | |
| SCHEMBL2527259 | 0.77 | TDP1 (0.44) | TDP1L3MBTL1CASP6ATMAKR1C2 | |
| SCHEMBL913380 | 0.77 | TDP1 (0.47) | TDP1L3MBTL1CASP6ATMALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5686492-A | NMR DIAGNOSTIC AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-11-11 | — | — | US | disclosed |
| EP-0799197-A1 | DISUBSTITUTED P-FLUOROBENZOLSULFONAMIDES AND THEIR USE IN NMR DIAGNOSTICS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996019447-A1 | DISUBSTITUTED P-FLUOROBENZOLSULFONAMIDES AND THEIR USE IN NMR DIAGNOSTICS | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-06-27 | — | — | WO | disclosed |