Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.40 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | MDH2 | P40926 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11881664 | 0.89 | P2RX7 (0.51) | TSHRLMNAHTTACHECES1 | |
| SCHEMBL11877099 | 0.84 | P2RX7 (0.53) | TSHRP2RX7 | |
| SCHEMBL11878205 | 0.81 | TP53 (0.44) | CHRM5TSHRHTTP2RX7ALDH1A1 | |
| SCHEMBL11873522 | 0.78 | TRPA1 (0.40) | TSHRCES1P2RX7BCHE | |
| SCHEMBL11847278 | 0.78 | TSHR (0.80) | CHRM1CHRM3CHRM5TSHRLMNA | |
| SCHEMBL11807970 | 0.73 | CYP1A2 (0.54) | LMNAP2RX7 | |
| SCHEMBL11873165 | 0.71 | TSHR (0.51) | CHRM1CHRM3TSHRLMNAHTT | |
| SCHEMBL5430888 | 0.70 | CHRM1 (1.00) | CHRM1CHRM3CHRM5TSHRACHE | |
| SCHEMBL30391378 | 0.70 | CHRM1 (1.00) | CHRM1CHRM3CHRM5TSHRACHE | |
| SCHEMBL11875636 | 0.68 | ALDH1A1 (0.39) | LMNAHTTALDH1A1SMN1; SMN2L3MBTL1 |
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-3990844-A | ION EXCHANGING | PPG INDUSTRIES, INC. (US) | 1976-11-09 | — | — | US | disclosed |
| US-3984556-A | Alkyl-substituted-tricyclic quinazolinones for lowering blood pressure | SANDOZ, INC. (US) | 1976-10-05 | — | — | US | disclosed |
| US-3982000-A | Alkyl-substituted-tricyclic quinazolinones as bronchodilators | SANDOZ, INC. (US) | 1976-09-21 | — | — | US | disclosed |