Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 2/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8772012 | 0.88 | AR (0.40) | ARCYP1A2ATMTDP1LMNA | |
| SCHEMBL6583252 | 0.81 | CYP1A2 (0.45) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL31558555 | 0.81 | CYP1A2 (0.45) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL6284211 | 0.80 | GPR35 (0.44) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL6284204 | 0.80 | GPR35 (0.44) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL8771996 | 0.78 | AR (0.44) | ARCYP1A2ATMTDP1LMNA | |
| SCHEMBL6179100 | 0.78 | TDP1 (0.44) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL3391673 | 0.78 | CYP1A2 (0.45) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL16418207 | 0.76 | CYP1A2 (0.44) | CYP1A2ATMTDP1LMNAMEN1 | |
| SCHEMBL16418206 | 0.76 | CYP1A2 (0.44) | CYP1A2ATMTDP1LMNAMEN1 |
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 |