Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 18/20 | 1.00 |
| ▸ | DRD2 | P14416 | 8/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.73 |
| ▸ | MAPT | P10636 | 3/20 | 0.73 |
| ▸ | DRD5 | P21918 | 3/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.73 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.73 |
| ▸ | THPO | P40225 | 2/20 | 0.73 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.73 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.73 |
| ▸ | PKM | P14618 | 1/20 | 0.73 |
| ▸ | RECQL | P46063 | 1/20 | 0.73 |
| ▸ | MTOR | P42345 | 1/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.73 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.71 |
| ▸ | BLM | P54132 | 2/20 | 0.71 |
| ▸ | GFER | P55789 | 2/20 | 0.71 |
| ▸ | GALR3 | O60755 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11251616 | 0.99 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL11540532 | 0.90 | DRD1 (0.81) | DRD1DRD2KDM4EMAPTDRD5 | |
| Bromide SCHEMBL11099172 | 0.88 | DRD1 (0.81) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL14494977 | 0.88 | DRD1 (0.78) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL14510736 | 0.88 | DRD1 (0.78) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL7937511 | 0.84 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL398776 | 0.84 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL29389414 | 0.84 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL11163152 | 0.84 | DRD1 (0.73) | DRD1DRD2KDM4EMAPTDRD5 | |
| SCHEMBL11541489 | 0.84 | DRD1 (0.72) | DRD1DRD2KDM4EMAPTDRD5 |
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-4255422-A | DIURETICS, TREATMENT OF CARDIOVASCULAR DISORDERS | SMITHKLINE CORPORATION (US) | 1981-03-10 | — | — | US | claimed |
| US-4255422-A | DIURETICS, TREATMENT OF CARDIOVASCULAR DISORDERS | SMITHKLINE CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |
| US-4192872-A | ANTI -PARKINSONISM ACTIVITY | SMITHKLINE CORPORATION (US) | 1980-03-11 | — | — | US | disclosed |
| US-4160765-A | Method for 6-bromination of 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds | SMITHKLINE CORPORATION (US) | 1979-07-10 | — | — | US | disclosed |