Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL17130935 | 1.00 | TSHR (0.37) | TSHRLMNAPOLBALDH1A1TDP1 | |
| SCHEMBL17130830 | 0.80 | ARG1 (0.35) | TDP1 | |
| SCHEMBL16771694 | 0.80 | ARG1 (0.35) | TDP1 | |
| Hydrochloric Acid SCHEMBL18259387 | 0.78 | ARG1 (0.34) | TDP1 | |
| Hydrochloric Acid SCHEMBL17111231 | 0.78 | ARG1 (0.34) | TDP1 | |
| SCHEMBL15515902 | 0.75 | TSHR (0.35) | TSHRLMNAPOLBALDH1A1RAB9A | |
| SCHEMBL15157454 | 0.75 | TSHR (0.35) | TSHRLMNAPOLBALDH1A1RAB9A | |
| Hydrochloric Acid SCHEMBL27628172 | 0.74 | TSHR (0.34) | TSHRLMNAPOLBALDH1A1RAB9A | |
| SCHEMBL28183499 | 0.73 | GBA1 (0.34) | — | |
| SCHEMBL2441008 | 0.72 | BRD4 (0.31) | TSHRGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9771358-B2 | Dihydropyrimidine compounds and their application in pharmaceuticals | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2017-09-26 | — | — | US | disclosed |
| WO-2015144093-A1 | DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2015-10-01 | — | — | WO | disclosed |