Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 2/20 | 0.40 |
| ▸ | HTR1E | P28566 | 3/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 11/20 | 0.38 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1178161 | 0.92 | PTGES (0.44) | PTGESHTR1ES1PR3ACKR3SSTR1 | |
| SCHEMBL1178411 | 0.90 | PTGES (0.39) | PTGESHTR1ES1PR3ACKR3SSTR1 | |
| SCHEMBL7601883 | 0.90 | PTGES (0.42) | PTGESHTR1ES1PR3ACKR3SSTR1 | |
| Bicarbonate SCHEMBL3697753 | 0.83 | PTGES (0.46) | PTGESHTR1ES1PR3ACKR3MEN1 | |
| SCHEMBL1178537 | 0.82 | PTGES (0.42) | PTGESHTR1ES1PR3ACKR3MEN1 | |
| SCHEMBL1177749 | 0.81 | PTGES (0.38) | PTGESACKR3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7602898 | 0.80 | PTGER3 (0.38) | PTGESHTR1ES1PR3ACKR3MEN1 | |
| SCHEMBL1178138 | 0.79 | PTGES (0.46) | PTGESHTR1ES1PR3ACKR3MEN1 | |
| SCHEMBL1177281 | 0.78 | PTGES (0.41) | PTGESHTR1ES1PR3ACKR3MEN1 | |
| SCHEMBL10006288 | 0.77 | HTR1E (0.59) | PTGESHTR1ES1PR3ACKR3SSTR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |