Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 5/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | UBE2N | P61088 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11871825 | 0.89 | CHRM1 (0.53) | P2RX7TSHRHTTLMNAALDH3A1 | |
| SCHEMBL11877099 | 0.88 | P2RX7 (0.53) | P2RX7TSHR | |
| SCHEMBL11807970 | 0.84 | CYP1A2 (0.54) | P2RX7LMNACASP3CYP1A2CYP2C19 | |
| SCHEMBL11873165 | 0.82 | TSHR (0.51) | P2RX7TSHRKMT2AHTTSOS1 | |
| SCHEMBL11878205 | 0.81 | TP53 (0.44) | P2RX7TSHRHTT | |
| SCHEMBL11842852 | 0.78 | TSHR (0.80) | TSHRKMT2AHTTSOS1LMNA | |
| SCHEMBL11873522 | 0.78 | TRPA1 (0.40) | P2RX7TSHRCES1 | |
| SCHEMBL11878613 | 0.77 | TSHR (0.50) | TSHRKMT2AHTTSOS1LMNA | |
| Hydrochloric Acid SCHEMBL11845788 | 0.77 | TSHR (0.78) | TSHRKMT2AHTTSOS1LMNA | |
| SCHEMBL11843146 | 0.76 | SOS1 (0.74) | TSHRKMT2AHTTSOS1LMNA |
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-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 |