Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | HTR7 | P34969 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR5A | P47898 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9042443 | 0.90 | HTR6 (0.40) | HTR6OPRD1USP2ALDH1A1TSHR | |
| SCHEMBL20527676 | 0.85 | HTR6 (0.40) | HTR6OPRD1USP2ALDH1A1TSHR | |
| SCHEMBL379430 | 0.77 | HTR6 (0.51) | HTR6ALDH1A1TSHRHSD17B10HTR1A | |
| SCHEMBL6746969 | 0.74 | ACVR1 (0.41) | HTR6USP2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL16600111 | 0.72 | HTR2A (0.41) | HTR6OPRD1USP2ALDH1A1TSHR | |
| SCHEMBL5570994 | 0.71 | SIGMAR1 (0.48) | SIGMAR1 | |
| SCHEMBL4151580 | 0.70 | BCAT2 (0.59) | ALDH1A1TSHRHSD17B10BCAT2IKBKB | |
| SCHEMBL27202066 | 0.69 | ALDH1A1 (0.51) | HTR6OPRD1USP2ALDH1A1TSHR | |
| SCHEMBL16599761 | 0.69 | HTR2A (0.39) | HTR6OPRD1USP2ALDH1A1TSHR | |
| SCHEMBL10077099 | 0.68 | HTR6 (0.49) | HTR6USP2ALDH1A1TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0712397-A1 | AMIDE DERIVATIVES AS 5HT1D RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-05-22 | — | — | EP | claimed |
| WO-1995004729-A1 | AMIDE DERIVATIVES AS 5HT1D RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-02-16 | — | — | WO | claimed |