Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 2/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30011105 | 0.87 | DPP4 (0.46) | DPP4KMT2ATDP1NFKB1SMN1; SMN2 | |
| SCHEMBL21437959 | 0.87 | DPP4 (0.46) | DPP4KMT2ATDP1NFKB1SMN1; SMN2 | |
| SCHEMBL24199952 | 0.85 | NLRP3 (0.41) | PKMEGFRMAPTDPP4TBXAS1 | |
| Hexane SCHEMBL31090092 | 0.82 | PPARG (0.45) | DPP4 | |
| Hexane SCHEMBL21439434 | 0.82 | PPARG (0.45) | DPP4 | |
| SCHEMBL25883697 | 0.81 | PKM (0.43) | PKMHDAC4HDAC6CYP4Z1CYP4F2 | |
| SCHEMBL30010570 | 0.80 | TRPA1 (0.47) | PKMCYP4Z1CYP4F2CYP4A11EGFR | |
| SCHEMBL21437511 | 0.80 | TRPA1 (0.47) | PKMCYP4Z1CYP4F2CYP4A11EGFR | |
| SCHEMBL27693821 | 0.79 | L3MBTL1 (0.43) | PKMCYP4Z1CYP4F2CYP4A11EGFR | |
| SCHEMBL31063213 | 0.78 | DPP4 (0.46) | DPP4KMT2ASMN1; SMN2 |
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-2019195720-A1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2019-10-10 | — | — | WO | disclosed |