Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.69 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.67 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7004405 | 0.85 | HTR2A (0.73) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL9889542 | 0.83 | HTR2A (0.71) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL12850609 | 0.82 | HTR2A (0.65) | HTR2AGPR84KEAP1NFE2L2HTR6 | |
| SCHEMBL9206509 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL7391194 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL11359977 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL5598636 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL18328036 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL5402680 | 0.81 | HTR2A (0.69) | HTR2AGPR84KEAP1NFE2L2SLC6A4 | |
| SCHEMBL332959 | 0.81 | HTR2A (1.00) | HTR2AGPR84KEAP1NFE2L2SLC6A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4066780-A | Pyranoindole derivatives as antiulcer agents | AYERST MCKENNA AND HARRISON LTD. (CA) | 1978-01-03 | — | — | US | disclosed |
| US-4066779-A | ANTIDEPRESSANT, ANTIULCER | AYERST, MCKENNA AND HARRISON LTD. (CA) | 1978-01-03 | — | — | US | disclosed |
| US-4041169-A | TREATING AND PREVENTING ULCERS | AYERST MCKENNA AND HARRISON LTD. (CA) | 1977-08-09 | — | — | US | disclosed |
| US-4003913-A | ANTIDEPRESSANTS, ANTIULCER AGENTS | AYERST MCKENNA AND HARRISON LTD. (CA) | 1977-01-18 | — | — | US | disclosed |