Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 5/20 | 0.50 |
| ▸ | CYP4F2 | P78329 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL26046942 | 0.86 | RAB9A (0.49) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL8887409 | 0.85 | KDM4E (0.58) | KDM4EALDH1A1HSD17B10CYP2C19 | |
| SCHEMBL8888175 | 0.82 | ALDH1A1 (0.44) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL23635271 | 0.81 | MAPT (0.47) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL10610210 | 0.81 | CYP4A11 (0.58) | CYP4A11CYP4F2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL29112786 | 0.78 | CA12 (0.59) | CYP4A11CYP4F2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL23927644 | 0.78 | CYP4A11 (0.55) | CYP4A11CYP4F2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL1025962 | 0.78 | CA12 (0.62) | KDM4EALDH1A1HSD17B10MAPTGAA | |
| SCHEMBL1826678 | 0.78 | MTNR1B (0.52) | KDM4EALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL30394564 | 0.77 | CYP4A11 (0.54) | CYP4A11CYP4F2KDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5602277-A | Substituted benzene derivatives useful as neuraminidase inhibitors | BIOCRYST PHARMACEUTICALS, INC. (US) | 1997-02-11 | — | — | US | disclosed |
| WO-1996030329-A1 | SUBSTITUTED BENZENE DERIVATIVES USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INCORPORATED (US) | 1996-10-03 | — | — | WO | disclosed |