Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH4 | P08319 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17174987 | 0.86 | LMNA (0.45) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL21143019 | 0.85 | DNM1 (0.41) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL6895295 | 0.83 | OPRM1 (0.41) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL6892670 | 0.83 | OPRM1 (0.41) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL19647379 | 0.81 | ADH1B (0.39) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL11299774 | 0.80 | OPRM1 (0.42) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL21728750 | 0.80 | OPRM1 (0.42) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL19708736 | 0.78 | OPRM1 (0.41) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL24409398 | 0.78 | OPRM1 (0.44) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL24394272 | 0.78 | OPRM1 (0.44) | ADH1BADH1CADH1AADH4ADH7 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170218414-A1 | MICROORGANISMS AND METHODS FOR THE BIOSYNTHESIS OF ADIPATE, HEXAMETHYLENEDIAMINE AND 6-AMINOCAPROIC ACID | AGAIN BIO APS (DK) | 2017-08-03 | — | — | US | disclosed |