Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9423324 | 0.80 | PARP1 (0.50) | PARP1KDM4ENPC1RAB9AADORA3 | |
| SCHEMBL9207322 | 0.70 | ALPI (0.55) | PARP1KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL23998523 | 0.69 | PARP1 (0.58) | PARP1KDM4EADORA3ALDH1A1PDE10A | |
| SCHEMBL28990863 | 0.68 | PARP1 (0.57) | PARP1KDM4EADORA3ALDH1A1PDE10A | |
| SCHEMBL4053642 | 0.67 | PARP1 (1.00) | PARP1ADORA3ADORA2A | |
| SCHEMBL3431339 | 0.66 | PARP1 (0.50) | PARP1KDM4ENPC1RAB9AADORA3 | |
| SCHEMBL9208448 | 0.64 | PDE6D (0.40) | PARP1KDM4EADORA3ALDH1A1MEN1 | |
| SCHEMBL9213755 | 0.64 | ALDH1A1 (0.48) | PARP1KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL23998512 | 0.63 | ADORA3 (0.51) | PARP1ADORA3ALDH1A1MEN1KMT2A | |
| SCHEMBL20075842 | 0.62 | NPC1 (0.50) | KDM4ENPC1RAB9AADORA3ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070148185-A1 | Novel therapeutic target for protozoal diseases | VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY | 2007-06-28 | — | — | US | claimed |
| WO-2007047579-A2 | A NOVEL THERAPEUTIC TARGET FOR PROTOZOAL DISEASES | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 2007-04-26 | — | — | WO | claimed |
| EP-1745021-A1 | HYDROFORMYLATION PROCESS FOR PHARMACEUTICAL INTERMEDIATE | The Dow Global Technologies Inc. (US) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005110986-A1 | HYDROFORMYLATION PROCESS FOR PHARMACEUTICAL INTERMEDIATE | DOW GLOBAL TECHNOLOGIES INC. (US) | 2005-11-24 | — | — | WO | disclosed |