Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3331448 | 0.79 | SIGMAR1 (0.44) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL5275290 | 0.77 | CSNK1E (0.40) | SIGMAR1ALDH1A1KCNH2BCHE | |
| SCHEMBL20640560 | 0.76 | TSHR (0.46) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL26989268 | 0.74 | TSHR (0.46) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL26987985 | 0.74 | TSHR (0.46) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL1834929 | 0.74 | TSHR (0.51) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL26988083 | 0.74 | TSHR (0.46) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL6054336 | 0.74 | TSHR (0.51) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL428101 | 0.74 | TSHR (0.46) | TSHRKMT2ANPSR1GAANPBWR1 | |
| SCHEMBL1834931 | 0.74 | TSHR (0.51) | TSHRKMT2ANPSR1GAANPBWR1 |
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-2020163415-A1 | SYNTHESIS OF 1,2,5-TRI-0-BENZ0YL-3-DIBENZYLAMIN0-3-DE0XYRIB0SE AS INTERMEDIATE FOR PRODUCING 3'-AMINO-3'-DEOXYADENOSINE AND 3'-AMINO-3'-DEOXYGUANOSINE AND THE PROTECTED DERIVATIVES THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 2020-08-13 | — | — | WO | disclosed |