Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11125673 | 0.89 | MEN1 (0.45) | TSHRMEN1KMT2AHPGDKCNA5 | |
| SCHEMBL10795586 | 0.84 | TSHR (0.57) | TSHRMEN1KMT2ATP53GAA | |
| Hydrochloric Acid SCHEMBL11069993 | 0.83 | TSHR (0.56) | TSHRMEN1KMT2ATP53GAA | |
| SCHEMBL10800156 | 0.78 | TSHR (0.52) | TSHRMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL10795826 | 0.76 | GAA (0.52) | TSHRMEN1KMT2AALDH1A1TP53 | |
| SCHEMBL11064805 | 0.75 | TSHR (0.47) | TSHRMEN1KMT2AHPGDCYP1A2 | |
| SCHEMBL10800120 | 0.75 | MEN1 (0.49) | TSHRMEN1KMT2APTGS2CYP1A2 | |
| SCHEMBL11071194 | 0.74 | TSHR (0.43) | TSHRMEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL11066311 | 0.74 | HTT (0.51) | TSHRKMT2AHPGDL3MBTL1CYP1A2 | |
| SCHEMBL10800850 | 0.72 | KMT2A (0.45) | TSHRMEN1KMT2AHPGDKCNA5 |
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 |