Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.55 |
| ▸ | CCR3 | P51677 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | DRD4 | P21917 | 4/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11778139 | 0.96 | GRIN2B (0.59) | SIGMAR1GRIN2BCCR3MEN1TP53 | |
| SCHEMBL11777245 | 0.91 | SIGMAR1 (0.56) | SIGMAR1GRIN2BCCR3DRD4DRD2 | |
| Hydrochloric Acid SCHEMBL11773957 | 0.90 | SIGMAR1 (0.55) | SIGMAR1CCR3DRD4DRD2DRD3 | |
| SCHEMBL3359734 | 0.83 | DRD2 (0.71) | SIGMAR1DRD4DRD2DRD3NOS2 | |
| SCHEMBL1307498 | 0.80 | NOS2 (0.54) | SIGMAR1MEN1KMT2ADRD4DRD2 | |
| SCHEMBL13326542 | 0.78 | DRD2 (0.65) | SIGMAR1DRD4DRD2DRD3 | |
| SCHEMBL4265725 | 0.78 | DRD2 (0.58) | SIGMAR1DRD4DRD2DRD3NOS2 | |
| SCHEMBL5315582 | 0.77 | NOS2 (0.64) | SIGMAR1MEN1KMT2ADRD4DRD2 | |
| SCHEMBL6704469 | 0.77 | SIGMAR1 (0.68) | SIGMAR1CCR3MEN1TP53CYP1A2 | |
| SCHEMBL12440506 | 0.76 | NOS2 (0.62) | DRD4DRD2DRD3POLBNOS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-3993762-A | NON-NARCOTIC ANALGESICS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-11-23 | — | — | US | disclosed |
| US-3933832-A | NON-NARCOTIC ANALGESICS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-01-20 | — | — | US | disclosed |