Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | FURIN | P09958 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1976289 | 0.84 | CA5A (0.52) | CA5ACREBBPNPC1MAPTRAB9A | |
| SCHEMBL2628599 | 0.84 | CA5A (0.52) | CA5ACREBBPNPC1MAPTRAB9A | |
| SCHEMBL15709749 | 0.84 | CA5A (0.52) | CA5ANPC1MAPTRAB9APARP1 | |
| SCHEMBL343284 | 0.84 | CA5A (0.52) | CA5ANPC1MAPTRAB9APARP1 | |
| SCHEMBL7184528 | 0.82 | PBRM1 (0.42) | NPC1MAPTRAB9APARP1LMNA | |
| SCHEMBL30197207 | 0.80 | KDM4E (0.47) | CA5AMAPTPARP1LMNAKDM4E | |
| SCHEMBL1028516 | 0.80 | KDM4E (0.47) | CA5AMAPTPARP1LMNAKDM4E | |
| SCHEMBL15484864 | 0.80 | PARP1 (0.52) | MAPTPARP1LMNAKDM4EHTT | |
| SCHEMBL24150559 | 0.78 | TUBB4A (0.46) | CREBBPMTORLMNAKDM4EHTT | |
| SCHEMBL176618 | 0.78 | NOTUM (0.57) | NPC1MAPTLMNAKDM4ENOTUM |
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-2597087-B1 | Dihydrooxazine and tetrahydropyrimidine derivatives as BACE 1 inhibitors | SHIONOGI & CO (JP) | 2016-03-30 | — | — | EP | disclosed |