Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1A | P07327 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.31 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.31 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL6863578 | 0.83 | GNAI3 (0.43) | ADH1AADH1CCYP1A2GNAI3GNAO1 | |
| Cyclohexylamine SCHEMBL6865736 | 0.83 | GNAI3 (0.43) | ADH1AADH1CCYP1A2GNAI3GNAO1 | |
| Cyclohexylamine SCHEMBL2067439 | 0.82 | CYP1A2 (0.42) | ALDH1A1CYP1A2MMP8MMP1GNAI3 | |
| Cyclohexylamine SCHEMBL10442353 | 0.81 | KMT2A (0.41) | ADH1AALDH1A1ADH1CCYP1A2MMP8 | |
| Cyclohexylamine SCHEMBL6278739 | 0.80 | ALDH1A1 (0.38) | ADH1AALDH1A1ADH1CCYP1A2MMP8 | |
| Cyclohexylamine SCHEMBL4447887 | 0.79 | SHBG (0.39) | ALDH1A1CYP1A2MMP8MMP1SHBG | |
| Cyclohexylamine SCHEMBL588721 | 0.77 | CYP1A2 (0.50) | CYP1A2GNAI3GNAO1GNAI1 | |
| Cyclohexylamine SCHEMBL1782618 | 0.77 | CYP1A2 (0.39) | ALDH1A1CYP1A2MMP8MMP1GNAI3 | |
| Cyclohexylamine SCHEMBL29057250 | 0.77 | CYP1A2 (0.50) | ALDH1A1CYP1A2GNAI3GNAO1GNAI1 | |
| Cyclohexylamine SCHEMBL20703173 | 0.76 | EPHX1 (0.38) | ALDH1A1CYP1A2MMP8MMP1SHBG |
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-6806289-B1 | SUCH AS AMMINE (2-AMINO-3-PICOLINE) DICHLOROPLATINUM(II); EFFICIENCY AND SELECTIVITY FOR DESTROYING TRANSFORMED CELLS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-10-19 | — | — | US | disclosed |