Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 7/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | PPARG | P37231 | 2/20 | 0.56 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.56 |
| ▸ | SLC22A8 | Q8TCC7 | 2/20 | 0.56 |
| ▸ | SLC22A11 | Q9NSA0 | 2/20 | 0.56 |
| ▸ | ALB | P02768 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | PGR | P06401 | 4/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | DAO | P14920 | 1/20 | 0.49 |
| ▸ | SNCA | P37840 | 1/20 | 0.49 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.49 |
| ▸ | APEX1 | P27695 | 3/20 | 0.49 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10828579 | 1.00 | NR1I2 (0.58) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| Hydrochloric Acid SCHEMBL10829386 | 0.91 | NR1I2 (0.59) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| Hydrochloric Acid SCHEMBL10829392 | 0.91 | NR1I2 (0.59) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| Hydrochloric Acid SCHEMBL10828643 | 0.89 | NR1I2 (0.58) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| Hydrochloric Acid SCHEMBL10828638 | 0.89 | NR1I2 (0.58) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| SCHEMBL9481118 | 0.88 | TDP1 (0.63) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| SCHEMBL9481165 | 0.88 | TDP1 (0.63) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| SCHEMBL10828601 | 0.87 | NR1I2 (0.52) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| SCHEMBL10828610 | 0.87 | NR1I2 (0.52) | NR1I2HTR2CMAPTPPARGSLC22A6 | |
| SCHEMBL10857452 | 0.86 | MAPT (0.77) | NR1I2HTR2CMAPTPPARGSLC22A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4596869-A | Pyridinyl and pyrimidinyl derivatives | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1986-06-24 | — | — | US | disclosed |
| US-4395411-A | ANTIBIOTICS; BACTERICIDES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1983-07-26 | — | — | US | disclosed |
| US-4267176-A | Amino or acylamino-substituted pyrimidinyl cephalosporanic acid derivatives and pharmaceutical compositions thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1981-05-12 | — | — | US | disclosed |