Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.33 |
| ▸ | CHRNG | P07510 | 1/20 | 0.33 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.33 |
| ▸ | CHRND | Q07001 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3552547 | 0.66 | SLC6A2 (0.42) | CHRNB2SLC6A2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL3389800 | 0.65 | ALDH1A1 (0.43) | OPRM1OPRD1OPRK1OPRL1GAA | |
| SCHEMBL4390692 | 0.65 | HTR2A (0.42) | CHRNB2SLC6A2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL15532563 | 0.65 | SIGMAR1 (0.44) | MAPTSIGMAR1GAA | |
| SCHEMBL3904043 | 0.63 | ALDH1A1 (0.36) | SMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL5466007 | 0.62 | ALDH1A1 (0.41) | SLC6A2SLC6A3OPRM1OPRK1OPRL1 | |
| SCHEMBL4391087 | 0.62 | HTR2A (0.48) | SMN1; SMN2OPRM1 | |
| SCHEMBL440389 | 0.61 | ALDH1A1 (0.40) | SMN1; SMN2MAPTOPRM1OPRD1OPRK1 | |
| SCHEMBL3361640 | 0.61 | CHRNB2 (0.49) | CHRNB2SLC6A2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL3890122 | 0.60 | APLNR (0.44) | SLC6A2SLC6A3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0134338-A1 | Process for preparing polyol-catalyst mixtures useful in the preparation of rigid polyurethane cellular products | TEXACO DEVELOPMENT CORPORATION (US) | 1985-03-20 | — | — | EP | disclosed |
| US-4465791-A | REACTING WATER, A MANNICH BASE COMPOUND AND AN EPOXIDE | TEXACO INC. (PARENT) (US) | 1984-08-14 | — | — | US | disclosed |
| US-4404121-A | REACTING A MANNICH BASE WITH WATER AND AN EPOXIDE | TEXACO INC. (US) | 1983-09-13 | — | — | US | disclosed |