Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 3/20 | 0.34 |
| ▸ | TDO2 | P48775 | 2/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | GABRE | P78334 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17875624 | 0.85 | S100A4 (0.47) | S100A4TRPV1VCAM1LMNAGPR35 | |
| SCHEMBL15218940 | 0.83 | TSHR (0.53) | VCAM1GPR35KDM4ESMN1; SMN2 | |
| SCHEMBL2107697 | 0.81 | VCAM1 (0.37) | VCAM1CYP1A2 | |
| SCHEMBL17875627 | 0.81 | ALDH1A1 (0.51) | VCAM1CYP1A2GAAMAPK1 | |
| SCHEMBL30413307 | 0.81 | ALDH1A1 (0.51) | VCAM1CYP1A2GAAMAPK1 | |
| SCHEMBL22658179 | 0.80 | ALDH1A1 (0.39) | S100A4TRPV1LMNAGPR35KDM4E | |
| SCHEMBL709464 | 0.79 | ALDH1A1 (0.42) | TRPV1VCAM1LMNAGPR35KDM4E | |
| SCHEMBL13931955 | 0.79 | ALDH1A1 (0.47) | KDM4ESMN1; SMN2MAPK1 | |
| SCHEMBL1796916 | 0.79 | VCAM1 (0.53) | VCAM1LMNAGAAMAPK1 | |
| SCHEMBL38666571 | 0.78 | VCAM1 (0.39) | VCAM1KDM4E |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1542869-A4 | MOLECULAR SCALE ELECTRONIC DEVICES | UNIV YALE (US) | 2005-06-22 | — | — | EP | disclosed |
| EP-1542869-A2 | MOLECULAR SCALE ELECTRONIC DEVICES | Yale University (US) | 2005-06-22 | — | — | EP | disclosed |
| US-20050101063-A1 | Three-terminal field-controlled molecular devices | TOUR JAMES M (US) | 2005-05-12 | — | — | US | disclosed |
| US-6756605-B1 | Molecular scale electronic devices | YALE UNIVERSITY | 2004-06-29 | — | — | US | disclosed |
| WO-2001027972-A9 | MOLECULAR SCALE ELECTRONIC DEVICES | UNIV YALE (US) | 2002-11-14 | — | — | WO | disclosed |
| WO-2002035580-A2 | THREE-TERMINAL FIELD-CONTROLLED MOLECULAR DEVICES | MOLECULAR ELECTRONICS CORPORATION (US) | 2002-05-02 | — | — | WO | disclosed |
| WO-2001027972-A2 | MOLECULAR SCALE ELECTRONIC DEVICES | YALE UNIVERSITY (US) | 2001-04-19 | — | — | WO | disclosed |