Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL1694494 | 0.79 | LTA4H (0.47) | LTA4HCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL1658642 | 0.75 | CA4 (0.41) | LTA4HTSHRTDP1ALDH1A1MAPK1 | |
| Fluoride SCHEMBL28075272 | 0.73 | CA4 (0.39) | LTA4HTSHRTDP1ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL27679630 | 0.73 | CA4 (0.39) | LTA4HTSHRTDP1ALDH1A1MAPK1 | |
| SCHEMBL689760 | 0.69 | LTA4H (0.37) | LTA4HCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL3420693 | 0.69 | LTA4H (0.37) | LTA4HTSHRL3MBTL1ALDH1A1MAPK1 | |
| Methoxymethane SCHEMBL27496691 | 0.66 | LTA4H (0.80) | LTA4HCYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL15403757 | 0.66 | LMNA (0.39) | LTA4HCYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8969052 | 0.66 | LTA4H (0.50) | LTA4HTSHRL3MBTL1TDP1ALDH1A1 | |
| SCHEMBL1331014 | 0.65 | LTA4H (0.87) | LTA4HCYP1A2CYP2C9CYP2C19CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1934243-A1 | RING-CLOSING METATHESIS PROCESS FOR THE PREPARATION OF MACROCYCLIC PEPTIDES | Boehringer Ingelheim International GmbH (DE) | 2008-06-25 | — | — | EP | disclosed |
| EP-1863833-A2 | PROCESS FOR PREPARING MACROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-12-12 | — | — | EP | disclosed |
| WO-2007030656-A1 | RING-CLOSING METATHESIS PROCESS FOR THE PREPARATION OF MACROCYCLIC PEPTIDES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-03-15 | — | — | WO | disclosed |
| WO-2006096652-A2 | PROCESS FOR PREPARING MACROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2006-09-14 | — | — | WO | disclosed |