Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | FAP | Q12884 | 1/20 | 0.30 |
| ▸ | PITRM1 | Q5JRX3 | 1/20 | 0.30 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.30 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.30 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.30 |
| ▸ | KDM5A | P29375 | 1/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL378129 | 0.98 | TSHR (0.34) | ALDH1A1SMN1; SMN2TSHRNFKB1CYP2C19 | |
| SCHEMBL3469463 | 0.91 | TSHR (0.35) | TSHRNFKB1CYP2C19DPP4KDM5A | |
| Hydrochloric Acid SCHEMBL29089994 | 0.89 | TSHR (0.34) | TSHRNFKB1CYP2C19DPP4KDM5A | |
| SCHEMBL21296526 | 0.82 | — | — | |
| SCHEMBL20707613 | 0.81 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2TSHRNFKB1CYP2C19 | |
| SCHEMBL4020424 | 0.80 | ALDH1A1 (0.37) | ALDH1A1TSHRNFKB1CYP2C19KDM5A | |
| SCHEMBL15319783 | 0.78 | TSHR (0.39) | ALDH1A1TSHRNFKB1CYP2C19KDM5A | |
| SCHEMBL18711702 | 0.78 | TSHR (0.35) | ALDH1A1SMN1; SMN2TSHRNFKB1CYP2C19 | |
| SCHEMBL10590189 | 0.77 | TSHR (0.34) | ALDH1A1TSHRNFKB1CYP2C19KDM5A | |
| SCHEMBL9059659 | 0.77 | F2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012101654-A2 | NOVEL TRIAZINE COMPOUNDS | SPHAERA PHARMA PVT. LTD (IN) | 2012-08-02 | — | — | WO | claimed |