Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 13/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | HPGD | P15428 | 2/20 | 0.69 |
| ▸ | NPC1 | O15118 | 1/20 | 0.69 |
| ▸ | RAB9A | P51151 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | DHODH | Q02127 | 1/20 | 0.60 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL3925984 | 0.91 | CHEK2 (0.74) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL2318980 | 0.86 | CHEK2 (1.00) | CHEK2 | |
| SCHEMBL3926681 | 0.86 | CHEK2 (0.81) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL3918418 | 0.85 | CHEK2 (0.84) | CHEK2KMT2A | |
| SCHEMBL6643299 | 0.85 | CHEK2 (1.00) | CHEK2KMT2A | |
| SCHEMBL5252669 | 0.85 | CHEK2 (0.70) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL3335320 | 0.84 | KDM4E (0.71) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL3918297 | 0.84 | CHEK2 (0.78) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL3927854 | 0.82 | CHEK2 (0.71) | CHEK2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL31679082 | 0.82 | KDM4E (1.00) | CHEK2KDM4EALDH1A1HPGDNPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7271261-B2 | Substituted benzimidazoles and imidazo-[4,5]-pyridines | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2007-09-18 | — | — | US | claimed |
| US-7271261-B2 | Substituted benzimidazoles and imidazo-[4,5]-pyridines | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2007-09-18 | — | — | US | disclosed |