Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 3/20 | 0.40 |
| ▸ | BRD4 | O60885 | 3/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GLS | O94925 | 4/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 1/20 | 0.34 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL21437701 | 0.89 | ESR1 (0.39) | BRD4CYP3A4CYP2C9ESR1POLB | |
| SCHEMBL21439488 | 0.82 | NAMPT (0.43) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL21437846 | 0.82 | SMN1; SMN2 (0.42) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL21438112 | 0.81 | NAMPT (0.45) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL21438660 | 0.81 | GLS (0.39) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL21437622 | 0.80 | BRD4 (0.40) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL21437629 | 0.76 | ACACB (0.40) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL23617124 | 0.74 | BRD4 (0.52) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL23616972 | 0.72 | BRD4 (0.47) | NAMPTBRD4CREBBPCYP2D6GLS | |
| SCHEMBL23616973 | 0.71 | BRD4 (0.45) | NAMPTBRD4CREBBPGLSGRM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3687506-A1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | Biocryst Pharmaceuticals, Inc. (US) | 2020-08-05 | — | — | EP | disclosed |
| WO-2019195720-A1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2019-10-10 | — | — | WO | disclosed |