Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 6/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.64 |
| ▸ | LMNA | P02545 | 5/20 | 0.64 |
| ▸ | RAB9A | P51151 | 4/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9632939 | 1.00 | MCHR1 (0.67) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL10647335 | 1.00 | MCHR1 (0.67) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL16114005 | 1.00 | MCHR1 (0.67) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL9568616 | 0.98 | MAPT (0.66) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL2484185 | 0.93 | MAPT (0.68) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL2484526 | 0.88 | MAPT (0.66) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL9247675 | 0.84 | MCHR1 (0.50) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL535379 | 0.84 | RAB9A (0.61) | MAPTKDM4ELMNARAB9ANPC1 | |
| SCHEMBL9244419 | 0.82 | MAPT (0.54) | MCHR1MAPTKDM4ELMNARAB9A | |
| SCHEMBL28900561 | 0.82 | RAB9A (0.63) | MAPTKDM4ELMNARAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2084163-B1 | TETRACYCLIC INHIBITORS OF CYSTEINE PROTEASES, THE PHARMACEUTICAL COMPOSITIONS THEREOF AND THEIR THERAPEUTIC APPLICATIONS | HYBRIGENICS SA (FR) | 2017-04-12 | — | — | EP | claimed |