Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.71 |
| ▸ | HTR7 | P34969 | 1/20 | 0.67 |
| ▸ | HTR6 | P50406 | 1/20 | 0.67 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.60 |
| ▸ | CNOT7 | Q9UIV1 | 2/20 | 0.58 |
| ▸ | HTR1A | P08908 | 3/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.58 |
| ▸ | DRD2 | P14416 | 3/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.58 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL683634 | 0.92 | HTR7 (0.67) | TSHRALDH1A1HTR7HTR6ADORA2B | |
| SCHEMBL10896437 | 0.87 | HTR7 (0.85) | TSHRALDH1A1HTR7HTR6HTR1A | |
| SCHEMBL10893180 | 0.85 | HTR7 (0.62) | TSHRALDH1A1HTR7HTR6ADORA2B | |
| SCHEMBL17786242 | 0.84 | ALDH1A1 (1.00) | TSHRALDH1A1ADORA2BSMN1; SMN2RXFP1 | |
| SCHEMBL10897677 | 0.84 | ADORA2B (0.68) | TSHRHTR7HTR6ADORA2BSMN1; SMN2 | |
| SCHEMBL10896421 | 0.84 | ADORA2B (0.64) | TSHRHTR7HTR6ADORA2BSMN1; SMN2 | |
| SCHEMBL10895853 | 0.83 | HTR1A (0.64) | TSHRALDH1A1HTR7HTR6ADORA2B | |
| Hydrochloric Acid SCHEMBL10895055 | 0.83 | ADORA2B (0.67) | TSHRHTR7HTR6ADORA2BSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10896457 | 0.83 | ADORA2B (0.67) | TSHRHTR7HTR6ADORA2BSMN1; SMN2 | |
| SCHEMBL684342 | 0.82 | SMN1; SMN2 (0.70) | TSHRALDH1A1HTR7HTR6ADORA2B |
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-4599414-A | ANTHISTAMINES, VASODILATORS | EISAI CO., LTD. (JP) | 1986-07-08 | — | — | US | disclosed |
| EP-0023350-A1 | Theophylline derivatives, a process for the preparation of the same and a therapeutical composition | Eisai Co., Ltd. (JP) | 1981-02-04 | — | — | EP | disclosed |