Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 3/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | CALCRL | Q16602 | 5/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12050628 | 0.93 | CALCRL (0.40) | NAMPTBRD4PRMT5CALCRLKCNA5 | |
| SCHEMBL12990910 | 0.80 | ADM2 (0.45) | CALCRL | |
| SCHEMBL14535761 | 0.78 | NPBWR1 (0.42) | CALCRLSMN1; SMN2 | |
| SCHEMBL12050633 | 0.70 | CALCRL (0.50) | CALCRLSMN1; SMN2 | |
| SCHEMBL31048537 | 0.66 | KCNA5 (0.49) | NAMPTBRD4PRMT5KCNA5 | |
| SCHEMBL23382156 | 0.65 | GRIA1 (0.52) | BRD4KCNA5AKT1CREBBP | |
| SCHEMBL12050621 | 0.65 | CALCRL (0.45) | CALCRL | |
| SCHEMBL12050574 | 0.64 | KCNA5 (0.54) | NAMPTKCNA5AKT1TRPV1 | |
| SCHEMBL3750932 | 0.64 | KCNA5 (0.54) | KCNA5 | |
| SCHEMBL7791651 | 0.64 | KCNA5 (0.54) | NAMPTKCNA5AKT1PDCD1CD274 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007061676-A2 | SPIROHYDANTOIN ARYL CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | disclosed |