Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7543685 | 1.00 | DRD2 (0.53) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL7545830 | 0.91 | DRD2 (0.49) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL7545826 | 0.91 | DRD2 (0.49) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL7542681 | 0.89 | DRD2 (0.48) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL7542678 | 0.89 | DRD2 (0.48) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL27272886 | 0.88 | CA1 (0.45) | RXRARXRBRXRGFFAR1 | |
| Hydrochloric Acid SCHEMBL28545277 | 0.87 | CA1 (0.44) | RXRARXRBRXRGFFAR1 | |
| Hydrochloric Acid SCHEMBL9363989 | 0.84 | DRD2 (0.54) | DRD2DRD3ACHEOPRK1MAPT | |
| SCHEMBL9195127 | 0.82 | ACHE (0.49) | DRD2DRD3ACHE | |
| SCHEMBL5679141 | 0.82 | ACHE (0.49) | DRD2DRD3ACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0894787-B1 | 3,4-DISUBSTITUTED PHENYLETHANOLAMINOTETRALINCARBOXYLATE DERIVATIVES | KISSEI PHARMACEUTICAL (JP) | 2002-06-12 | — | — | EP | disclosed |
| US-6136852-A | 3,4-disubstituted phenylethanolaminotetralincarboxylic acid derivatives | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2000-10-24 | — | — | US | disclosed |
| EP-0894787-A1 | 3,4-DISUBSTITUTED PHENYLETHANOLAMINOTETRALINCARBOXYLATE DERIVATIVES | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 1999-02-03 | — | — | EP | disclosed |