Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PTPRF | P10586 | 1/20 | 0.45 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10465146 | 0.84 | HTT (0.88) | HTTCA1CA2CA9NR3C1 | |
| SCHEMBL6512769 | 0.78 | HSD11B1 (0.56) | HTTCA1CA2CA9KMT2A | |
| SCHEMBL18045525 | 0.78 | HTT (1.00) | HTTCA1CA2CA9NR3C1 | |
| Hydrochloric Acid SCHEMBL9800374 | 0.78 | RECQL (0.54) | CA1CA2CA9NR3C1KMT2A | |
| SCHEMBL24541236 | 0.78 | TSHR (0.53) | CA1CA2CA9TSHRMAPT | |
| SCHEMBL28326326 | 0.77 | HTT (0.66) | HTTCA1CA2CA9NR3C1 | |
| SCHEMBL28531315 | 0.77 | TSHR (0.60) | CA1CA2CA9TSHRCYP2C19 | |
| SCHEMBL27575275 | 0.76 | ALDH1A1 (0.56) | HTTKMT2ACYP1A2CYP2C19MEN1 | |
| SCHEMBL13946243 | 0.76 | CYP1A2 (0.67) | HTTKMT2ATSHRCYP1A2CYP2C19 | |
| SCHEMBL11041999 | 0.76 | HTT (0.59) | HTTCA1CA2CA9NR3C1 |
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-4994483-A | 5-substituted-3-aminoalkyl indole derivatives for migraine | GLAXO GROUP LIMITED (GB) | 1991-02-19 | — | — | US | disclosed |