Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.67 |
| ▸ | DRD2 | P14416 | 8/20 | 0.66 |
| ▸ | DRD3 | P35462 | 7/20 | 0.66 |
| ▸ | DRD4 | P21917 | 3/20 | 0.66 |
| ▸ | HTR1D | P28221 | 1/20 | 0.66 |
| ▸ | HTR1B | P28222 | 1/20 | 0.66 |
| ▸ | MAOA | P21397 | 1/20 | 0.64 |
| ▸ | MAOB | P27338 | 1/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.57 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL8393323 | 1.00 | GRIN2B (0.67) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL29588340 | 1.00 | GRIN2B (0.67) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL31208094 | 1.00 | GRIN2B (0.67) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL2598589 | 1.00 | GRIN2B (0.67) | GRIN2BDRD2DRD3DRD4HTR1D | |
| Hydrochloric Acid SCHEMBL7935272 | 0.98 | GRIN2B (0.65) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL1792787 | 0.87 | GRIN2B (0.61) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL10293234 | 0.86 | MAOA (0.68) | GRIN2BDRD2DRD3DRD4MAOA | |
| Hydrochloric Acid SCHEMBL7383661 | 0.84 | MAOA (0.66) | GRIN2BDRD2DRD3DRD4MAOA | |
| SCHEMBL9757841 | 0.80 | DRD2 (0.86) | GRIN2BDRD2DRD3DRD4HTR1D | |
| SCHEMBL8340148 | 0.80 | HTR1D (0.58) | GRIN2BDRD2DRD3DRD4HTR1D |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011146610-A2 | AN ENANTIOSELECTIVE SYNTHESIS OF CHIRAL AMINES FOR THE PRODUCTION OF ROTIGOTINE | DR. REDDY'S LABORATORIES LTD. (IN) | 2011-11-24 | — | — | WO | claimed |
| WO-2011146610-A2 | AN ENANTIOSELECTIVE SYNTHESIS OF CHIRAL AMINES FOR THE PRODUCTION OF ROTIGOTINE | DR. REDDY'S LABORATORIES LTD. (IN) | 2011-11-24 | — | — | WO | disclosed |
| US-6008219-A | Bicyclic amine derivatives and their use as anti-psychotic agents | SMITHKLINE BEECH P.L.C. (GB) | 1999-12-28 | — | — | US | disclosed |
| EP-0817767-A1 | BICYCLIC AMINE DERIVATIVES AND THEIR USE AS ANTI-PSYCHOTIC AGENTS | SMITHKLINE BEECHAM PLC (GB) | 1998-01-14 | — | — | EP | disclosed |
| WO-1996030333-A1 | BICYCLIC AMINE DERIVATIVES AND THEIR USE AS ANTI-PSYCHOTIC AGENTS | SMITHKLINE BEECHAM PLC (GB) | 1996-10-03 | — | — | WO | disclosed |