Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.51 |
| ▸ | CCR5 | P51681 | 1/20 | 0.51 |
| ▸ | CCR8 | P51685 | 1/20 | 0.51 |
| ▸ | CBFB | Q13951 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.44 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7965613 | 0.85 | CYP2C9 (0.55) | CBFBKDM4ESMN1; SMN2HSD17B10RXFP1 | |
| SCHEMBL8338056 | 0.84 | METAP1 (0.48) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL8334494 | 0.84 | KMT2A (0.48) | CCR1CCR5CCR8KDM4EALDH1A1 | |
| SCHEMBL8333690 | 0.83 | CBFB (0.46) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL8336808 | 0.83 | NPSR1 (0.46) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL8334580 | 0.83 | NPC1 (0.47) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL8335864 | 0.83 | CBFB (0.46) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL19050397 | 0.82 | MAPK1 (0.55) | CCR1CCR5CCR8CBFBKDM4E | |
| SCHEMBL16098232 | 0.81 | MAPK1 (0.54) | KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL8336614 | 0.80 | KDM4E (0.54) | KDM4EADORA3NPSR1METAP1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5969150-A | FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES | THE ROCKEFELLER UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |