Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 4/20 | 0.41 |
| ▸ | CCR1 | P32246 | 2/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | ADAMTS5 | Q9UNA0 | 4/20 | 0.37 |
| ▸ | MMP14 | P50281 | 2/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6385406 | 0.82 | GFER (0.35) | CNR1CNR2MEN1KMT2APOLB | |
| SCHEMBL24434909 | 0.81 | MEN1 (0.49) | SIGMAR1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL29998949 | 0.81 | DRD2 (0.41) | CNR1DRD4SIGMAR1ADAMTS5MMP14 | |
| SCHEMBL9893030 | 0.79 | DRD4 (0.43) | CNR1CNR2DRD4CCR1TMEM97 | |
| SCHEMBL9891887 | 0.78 | CNR2 (0.45) | CNR1CNR2DRD4CCR1TMEM97 | |
| SCHEMBL3806529 | 0.75 | DRD4 (0.53) | CNR1CNR2DRD4CCR1TMEM97 | |
| SCHEMBL3806525 | 0.75 | DRD4 (0.53) | CNR1CNR2DRD4CCR1TMEM97 | |
| SCHEMBL4940440 | 0.73 | DRD2 (0.40) | DRD4ADAMTS5MMP14DRD2MEN1 | |
| SCHEMBL4940436 | 0.73 | DRD2 (0.40) | DRD4ADAMTS5MMP14DRD2MEN1 | |
| SCHEMBL3245667 | 0.72 | RAD52 (0.40) | MEN1KMT2APOLBALDH1A1 |
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-8629157-B2 | Pyrrolidine compounds which modulate the CB2 receptor | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-01-14 | — | — | US | disclosed |