Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 6/20 | 0.64 |
| ▸ | NPC1 | O15118 | 8/20 | 0.63 |
| ▸ | RAB9A | P51151 | 8/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | PKM | P14618 | 4/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.59 |
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3915259 | 0.90 | CHEK2 (0.65) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL3925755 | 0.88 | CHEK2 (0.66) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL3417342 | 0.87 | KDM4E (0.76) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL14434505 | 0.85 | CHEK2 (0.66) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL3335320 | 0.84 | KDM4E (0.71) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL5634840 | 0.83 | NPC1 (0.91) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL5636118 | 0.82 | CHEK2 (0.63) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL13015025 | 0.82 | NPC1 (0.88) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL3919844 | 0.82 | KDM4E (0.68) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL3928103 | 0.81 | CHEK2 (0.67) | CHEK2NPC1RAB9ASMN1; SMN2KDM4E |
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 |