Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 14/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL505378 | 0.93 | DHODH (0.69) | DHODHHDAC6KDM4ERAB9AACMSD | |
| SCHEMBL506154 | 0.90 | DHODH (0.67) | DHODHHDAC6KDM4ERAB9AACMSD | |
| SCHEMBL505457 | 0.88 | DHODH (0.68) | DHODHHDAC6KDM4ERAB9A | |
| SCHEMBL6840296 | 0.87 | RAB9A (0.56) | DHODHKDM4ERAB9ANPC1ALDH1A1 | |
| SCHEMBL536117 | 0.86 | DHODH (0.60) | DHODHHDAC6 | |
| SCHEMBL505990 | 0.85 | DHODH (0.57) | DHODHHDAC6KDM4EACMSDALDH1A1 | |
| SCHEMBL536113 | 0.84 | DHODH (0.58) | DHODHHDAC6KDM4ERAB9AALDH1A1 | |
| SCHEMBL505906 | 0.84 | DHODH (0.58) | DHODHHDAC6KDM4ERAB9AACMSD | |
| SCHEMBL505582 | 0.84 | DHODH (0.64) | DHODHKDM4ETP53MAPTALDH1A1 | |
| SCHEMBL6840189 | 0.81 | PIN1 (0.58) | DHODHKDM4ERAB9ATP53MAPT |
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-2414328-A2 | DIHYDROOROTATE DEHYDROGENASE INHIBITORS | Merck Serono S.A. (CH) | 2012-02-08 | — | — | EP | disclosed |