Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | SOX18 | P35713 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | VNN1 | O95497 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | PTGFR | P43088 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7901233 | 1.00 | CYP1A2 (0.50) | CYP1A2SOX18HDAC1HDAC8SLC13A5 | |
| SCHEMBL27862101 | 0.84 | CYP1A2 (0.57) | CYP1A2SOX18HDAC1HDAC8SLC13A5 | |
| SCHEMBL16595623 | 0.79 | PPARG (0.50) | CYP1A2SOX18HDAC1HDAC8CES2 | |
| SCHEMBL17996493 | 0.78 | CYP1A2 (0.47) | CYP1A2SOX18HDAC1HDAC8CYP2A6 | |
| SCHEMBL21443063 | 0.77 | CYP1A2 (0.47) | CYP1A2SOX18HDAC1HDAC8SLC13A5 | |
| SCHEMBL6799708 | 0.75 | MMP12 (0.65) | CYP1A2SOX18SLC13A5PDPK1 | |
| SCHEMBL2482277 | 0.75 | HTR2A (0.53) | CYP1A2SOX18HDAC1CYP2A6SIGMAR1 | |
| SCHEMBL27624076 | 0.75 | HTR2A (0.53) | CYP1A2SOX18HDAC1HDAC8CYP2A6 | |
| SCHEMBL6802719 | 0.74 | CYP1A2 (0.49) | CYP1A2SOX18HDAC1HDAC8SLC13A5 | |
| SCHEMBL28317527 | 0.73 | FFAR1 (0.40) | FFAR1PTGFR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0624652-B1 | Process for producing N-substituted polyhydroxy nitrogen-containing heterocycles | MONSANTO CO (US) | 2001-10-10 | — | — | EP | disclosed |
| EP-1132370-A2 | Process for producing n-substituted polyhydroxy nitrogen-containing heterocyles | MONSANTO COMPANY (US) | 2001-09-12 | — | — | EP | disclosed |
| US-5695969-A | Process for producing N-substituted polyhydroxy nitrogen-containing heterocycles | MONSANTO COMPANY (US) | 1997-12-09 | — | — | US | disclosed |
| US-5401645-A | Process for producing n-substituted polyhydroxy nitrogen-containing heterocycles utilizing acetobacteraceae and corynebacterium | MONSANTO COMPANY (US) | 1995-03-28 | — | — | US | disclosed |
| EP-0624652-A1 | Process for producing N-substituted polyhydroxy nitrogen-containing heterocycles | MONSANTO COMPANY (US) | 1994-11-17 | — | — | EP | disclosed |