Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | UBE2N | P61088 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.41 |
| ▸ | CLPP | Q16740 | 2/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 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 | |
|---|---|---|---|---|
| SCHEMBL11806199 | 0.90 | TSHR (0.69) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11802928 | 0.90 | TSHR (0.59) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11803813 | 0.89 | TSHR (0.56) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11800081 | 0.88 | TSHR (0.53) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11842852 | 0.82 | TSHR (0.80) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11804124 | 0.82 | HTT (0.49) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| Hydrochloric Acid SCHEMBL11845788 | 0.81 | TSHR (0.78) | CYP1A2CYP2C19TSHRHTTKMT2A | |
| SCHEMBL11800639 | 0.81 | RXFP1 (0.48) | TSHRKMT2A | |
| SCHEMBL11806264 | 0.81 | KCNN4 (0.52) | TSHRLMNAATMGAACLPP | |
| SCHEMBL11810117 | 0.81 | KMT2A (0.50) | CYP1A2CYP2C19TSHRHTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-3975386-A | PYRIDOPYRIMIDINE-ONE INTERMEDIATES | SANDOZ, INC. (US) | 1976-08-17 | — | — | US | disclosed |