Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | CLPP | Q16740 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ACP1 | P24666 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10795826 | 0.89 | GAA (0.52) | TSHRKMT2AMEN1CLPPGAA | |
| SCHEMBL10795586 | 0.88 | TSHR (0.57) | TSHRKMT2AMEN1CLPPGAA | |
| Hydrochloric Acid SCHEMBL11069993 | 0.87 | TSHR (0.56) | TSHRKMT2AMEN1CLPPGAA | |
| SCHEMBL11066311 | 0.83 | HTT (0.51) | TSHRKMT2ACLPPGAACYP2C19 | |
| SCHEMBL10800156 | 0.82 | TSHR (0.52) | TSHRKMT2AMEN1CLPPGAA | |
| SCHEMBL11071194 | 0.81 | TSHR (0.43) | TSHRKMT2AMEN1CLPPMAPT | |
| SCHEMBL11069166 | 0.78 | ALDH1A1 (0.44) | TSHRKMT2AMEN1GAACYP2C19 | |
| SCHEMBL10795495 | 0.77 | TSHR (0.50) | TSHRKMT2AMEN1CLPPGAA | |
| SCHEMBL11067241 | 0.75 | TSHR (0.42) | TSHRKMT2AMEN1GAACYP2C19 | |
| SCHEMBL10795290 | 0.75 | TSHR (0.50) | TSHRKMT2AMEN1CLPPGAA |
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-4489078-A | Diazaheterocyclopurines used as anti-broncho spasmatics and vasodilators | MEAD JOHNSON & COMPANY (US) | 1984-12-18 | — | — | US | claimed |
| US-4366156-A | Antiallergic methods using diazaheterocyclopurines | MEAD JOHNSON & COMPANY (US) | 1982-12-28 | — | — | US | claimed |