Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 3/20 | 0.59 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.52 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.47 |
| ▸ | SCD5 | Q86SK9 | 4/20 | 0.46 |
| ▸ | SCD | O00767 | 3/20 | 0.46 |
| ▸ | CCNC | P24863 | 1/20 | 0.45 |
| ▸ | CDK8 | P49336 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10002512 | 0.84 | RIPK1 (0.64) | RIPK1HCRTR2HSP90AA1HSP90AB1CHRNB2 | |
| SCHEMBL19446084 | 0.81 | NR1H2 (0.48) | RIPK1NR1H2NR1H3HCRTR2 | |
| SCHEMBL6960066 | 0.81 | RIPK1 (0.69) | RIPK1NR1H2NR1H3HCRTR2HSP90AA1 | |
| SCHEMBL20558229 | 0.81 | RIPK1 (0.56) | RIPK1NR1H2NR1H3HSP90AA1HSP90AB1 | |
| SCHEMBL18642714 | 0.81 | RIPK1 (0.69) | RIPK1NR1H2NR1H3HCRTR2HSP90AA1 | |
| SCHEMBL14252999 | 0.81 | RIPK1 (0.64) | RIPK1HSP90AA1HSP90AB1CHRNB2CHRNB4 | |
| SCHEMBL17453077 | 0.81 | RIPK1 (0.64) | RIPK1HSP90AA1HSP90AB1CHRNB2CHRNB4 | |
| SCHEMBL23064515 | 0.80 | RIPK1 (0.59) | RIPK1HSP90AA1HSP90AB1CHRNB2CHRNB4 | |
| SCHEMBL12184218 | 0.79 | RIPK1 (0.58) | RIPK1HSP90AA1HSP90AB1EPHX2HSD11B1 | |
| SCHEMBL27672000 | 0.79 | RIPK1 (0.58) | RIPK1HSP90AA1HSP90AB1EPHX2HSD11B1 |
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-9981910-B2 | Substituted pyrrolidines and methods of use | ABBVIE S.Á.R.L. (LU) | 2018-05-29 | — | — | US | disclosed |