Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18469162 | 0.93 | DPP4 (0.41) | NPSR1TSHRGLANAAATHRB | |
| SCHEMBL1696580 | 0.93 | DPP4 (0.41) | NPSR1TSHRGLANAAATHRB | |
| SCHEMBL24107384 | 0.91 | NPSR1 (0.34) | NPSR1TSHRGLANAAATHRB | |
| SCHEMBL5608327 | 0.90 | NAAA (0.38) | NPSR1TSHRGLANAAATHRB | |
| SCHEMBL5608375 | 0.89 | PKM (0.39) | NPSR1TSHRALDH1A1 | |
| SCHEMBL15449150 | 0.89 | TSHR (0.45) | NPSR1TSHRGLANAAATHRB | |
| SCHEMBL25455473 | 0.88 | CYP19A1 (0.35) | NPSR1TSHRTHRBALDH1A1 | |
| SCHEMBL26033111 | 0.88 | TSHR (0.33) | NPSR1TSHRGLANAAAALDH1A1 | |
| SCHEMBL25499084 | 0.88 | TSHR (0.33) | NPSR1TSHRGLANAAAALDH1A1 | |
| SCHEMBL18467358 | 0.88 | NPSR1 (0.34) | NPSR1TSHRGLANAAATHRB |
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-RE39744-E1 | Adamantane derivatives and process for producing them | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2007-07-24 | — | — | US | disclosed |
| US-6392104-B1 | CHEMICAL INTERMEDIATES FOR DRUGS, AGRICULTURE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| EP-0927711-A1 | ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM | Daicel Chemical Industries, Ltd. (JP) | 1999-07-07 | — | — | EP | disclosed |