Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL27851767 | 0.98 | TSHR (0.59) | TSHRMAPTKDM4EUSP2MAOA | |
| Hydrochloric Acid SCHEMBL27833742 | 0.96 | TSHR (0.57) | TSHRMAPTKDM4EUSP2MAOA | |
| SCHEMBL27851773 | 0.83 | ACHE (0.60) | TSHRMAPTKDM4EUSP2MAOA | |
| SCHEMBL1524562 | 0.81 | MAPT (0.44) | TSHRMAPTKDM4EUSP2MAOA | |
| SCHEMBL11391883 | 0.78 | CYP1A2 (0.57) | TSHRMAPTALDH1A1NPSR1MEN1 | |
| SCHEMBL8088583 | 0.78 | TSHR (0.48) | TSHRMAPTKDM4EUSP2ACHE | |
| SCHEMBL11843347 | 0.76 | USP2 (0.44) | TSHRMAPTKDM4EUSP2MAOA | |
| SCHEMBL11852636 | 0.75 | KDM4E (0.43) | TSHRMAPTKDM4EUSP2CHRM2 | |
| SCHEMBL11855903 | 0.75 | KDM4E (0.43) | TSHRMAPTKDM4EUSP2MAOA | |
| SCHEMBL18634398 | 0.74 | CHRNA7 (0.53) | TSHRDRD2DRD1ADRA1DADRA1A |
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-3980788-A | XANTHENYL COMPOUNDS | SMITHKLINE CORPORATION (US) | 1976-09-14 | — | — | US | disclosed |