Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 3/20 | 0.35 |
| ▸ | ADH1B | P00325 | 2/20 | 0.35 |
| ▸ | ADH1C | P00326 | 2/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | ADH7 | P40394 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6564265 | 0.98 | METAP1 (0.38) | METAP1CYP1A2ADH1AADH1BADH1C | |
| SCHEMBL28022207 | 0.87 | CYP1A2 (0.42) | METAP1CYP1A2SIGMAR1 | |
| Methylamine SCHEMBL27970228 | 0.84 | MAPT (0.40) | METAP1CYP1A2SIGMAR1 | |
| SCHEMBL4993524 | 0.83 | METAP1 (0.40) | METAP1CYP1A2ADH1AADH1BADH1C | |
| SCHEMBL4993518 | 0.83 | METAP1 (0.40) | METAP1CYP1A2ADH1AADH1BADH1C | |
| SCHEMBL23960 | 0.80 | ADH1C (0.38) | ADH1AADH1BADH1CADH4ADH7 | |
| SCHEMBL24601 | 0.78 | ADH1B (0.34) | ADH1AADH1BADH1CADH4ADH7 | |
| SCHEMBL9668102 | 0.77 | METAP1 (0.41) | METAP1CYP1A2ADH1AADH1BADH1C | |
| SCHEMBL28058465 | 0.76 | METAP1 (0.43) | METAP1CYP1A2METAP2SIGMAR1 | |
| SCHEMBL6566106 | 0.76 | PTPN1 (0.38) | METAP1CYP1A2METAP2 |
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-6172016-B1 | Fragrance materials | BUSH BOAKES ALLEN INC. | 2001-01-09 | — | — | US | claimed |
| EP-2424829-B1 | OMEGA-CYCLOHEXYLALKAN-1-OLES AND USE THEREOF AS ANTIMICROBIAL ACTIVES TO COMBAT BODY ODOR | SYMRISE AG (DE) | 2015-01-07 | — | — | EP | disclosed |
| US-6172016-B1 | Fragrance materials | BUSH BOAKES ALLEN INC. | 2001-01-09 | — | — | US | disclosed |
| US-6172016-B1 | Fragrance materials | BUSH BOAKES ALLEN INC. | 2001-01-09 | — | — | US | disclosed |