Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 12/20 | 0.67 |
| ▸ | DRD3 | P35462 | 7/20 | 0.67 |
| ▸ | DRD4 | P21917 | 5/20 | 0.62 |
| ▸ | DRD1 | P21728 | 4/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.62 |
| ▸ | THPO | P40225 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 4/20 | 0.62 |
| ▸ | HTR7 | P34969 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.61 |
| ▸ | DRD5 | P21918 | 1/20 | 0.59 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7334103 | 0.87 | DRD2 (0.66) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL7331703 | 0.84 | DRD2 (0.61) | DRD2DRD3DRD4DRD1CYP1A2 | |
| Hydrochloric Acid SCHEMBL7336566 | 0.79 | DRD2 (0.66) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL7327849 | 0.79 | DRD2 (0.59) | DRD2DRD3DRD4DRD1CYP1A2 | |
| SCHEMBL7335087 | 0.78 | DRD2 (0.64) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL30350387 | 0.77 | DRD2 (1.00) | DRD2DRD3DRD4DRD1CYP1A2 | |
| SCHEMBL7382314 | 0.77 | DRD2 (1.00) | DRD2DRD3DRD4DRD1CYP1A2 | |
| SCHEMBL26690439 | 0.77 | HTR7 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL8672358 | 0.76 | HTR1A (0.56) | DRD2DRD3CYP1A2CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL7327809 | 0.76 | DRD2 (0.76) | DRD2DRD3DRD4DRD1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5233052-A | Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds | AMERICAN CYANAMID COMPANY (US) | 1993-08-03 | — | — | US | disclosed |
| US-5196454-A | METHOD OF TREATING DISORDERS OF THE DOPAMINERGIC SYSTEMS USING 2,5-DIAMINOTETRALINES | BOEHRINGER INGELHEIM KG (DE) | 1993-03-23 | — | — | US | disclosed |
| EP-0402923-A2 | 2,5-Diaminotetralines, process for their preparation and their use as medicine | BOEHRINGER INGELHEIM KG (DE) | 1990-12-19 | — | — | EP | disclosed |