Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | METAP1 | P53582 | 4/20 | 0.54 |
| ▸ | CBFB | Q13951 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | DHODH | Q02127 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8338056 | 0.86 | METAP1 (0.48) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL13243235 | 0.85 | CYP3A4 (0.53) | CYP2C9CYP3A4METAP1KDM4ERXFP1 | |
| SCHEMBL8335864 | 0.85 | CBFB (0.46) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL8336808 | 0.85 | NPSR1 (0.46) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL8333690 | 0.85 | CBFB (0.46) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL8333603 | 0.85 | CCR1 (0.51) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL8334580 | 0.85 | NPC1 (0.47) | CYP2C9CYP3A4METAP1CBFBKDM4E | |
| SCHEMBL8336614 | 0.85 | KDM4E (0.54) | CYP2C9CYP3A4METAP1KDM4EDHODH | |
| SCHEMBL7952415 | 0.84 | CYP2C9 (0.56) | CYP2C9CYP3A4METAP1KDM4EDHODH | |
| SCHEMBL7962384 | 0.83 | CYP3A4 (0.57) | CYP2C9CYP3A4METAP1CBFBDHODH |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6187928-B1 | TREATING FUNGAL DISEASES | THE ROCKEFELLER UNIVERSITY | 2001-02-13 | — | — | US | disclosed |
| US-6087510-A | Method of use of imidazolium cations | THE ROCKEFELLER UNIVERSITY (US) | 2000-07-11 | — | — | US | disclosed |
| US-5874587-A | FLUORESCENCE | THE ROCKEFELLER UNIVERSITY (US) | 1999-02-23 | — | — | US | disclosed |