Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | DPP4 | P27487 | 2/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1047388 | 0.80 | CYP2C19 (0.35) | MIFCYP3A4SMN1; SMN2KDM4EMAPT | |
| SCHEMBL4443347 | 0.80 | MIF (0.52) | MIFCYP3A4SMN1; SMN2KDM4EMAPT | |
| SCHEMBL3261585 | 0.76 | CYP2C19 (0.36) | CYP3A4SMN1; SMN2KDM4EMAPTALOX15 | |
| SCHEMBL1162464 | 0.74 | CYP2C19 (0.35) | MIFCYP3A4KDM4EMAPTALOX15 | |
| Formic Acid SCHEMBL1162475 | 0.74 | CYP2D6 (0.35) | MIFCYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL28429021 | 0.73 | CYP2C19 (0.34) | MIFCYP3A4KDM4EMAPTALOX15 | |
| Phosphonic Acid SCHEMBL1162520 | 0.73 | CYP2C19 (0.34) | MIFCYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL3258485 | 0.72 | KDM4E (0.40) | CYP3A4KDM4EMAPTALOX15CYP2C19 | |
| SCHEMBL8525246 | 0.71 | ALDH1A1 (0.35) | CYP3A4SMN1; SMN2KDM4EMAPTALOX15 | |
| SCHEMBL11766335 | 0.69 | CYP2D6 (0.37) | CYP3A4KDM4EMAPTALOX15CYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1487896-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC Seibersdorf research GmbH (AT) | 2004-12-22 | — | — | EP | claimed |
| WO-2003082946-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC SEIBERSDORF RESEARCH GMBH (AT) | 2003-10-09 | — | — | WO | claimed |
| EP-1487896-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC Seibersdorf research GmbH (AT) | 2004-12-22 | — | — | EP | disclosed |
| EP-1487896-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC Seibersdorf research GmbH (AT) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003082946-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC SEIBERSDORF RESEARCH GMBH (AT) | 2003-10-09 | — | — | WO | disclosed |
| WO-2003082946-A1 | METHOD FOR ACTIVATING A COMPOSITION COMPRISING VINYLBENZYL THIOCYANATE AND/OR VINYLBENZYL SELENOCYANATE | ARC SEIBERSDORF RESEARCH GMBH (AT) | 2003-10-09 | — | — | WO | disclosed |