Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CD38 | P28907 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5304873 | 0.81 | NPC1 (0.60) | NPC1LMNASMYD3HPGDS | |
| SCHEMBL5406062 | 0.77 | MAPK14 (0.53) | NPC1LMNASMYD3CNR2HPGDS | |
| SCHEMBL29665841 | 0.77 | NPC1 (0.48) | NPC1LMNASMYD3EPHX1BRD4 | |
| SCHEMBL24632254 | 0.77 | NPC1 (0.48) | NPC1LMNASMYD3EPHX1BRD4 | |
| SCHEMBL29316717 | 0.75 | NPC1 (0.44) | NPC1LMNASMYD3EPHX1BRD4 | |
| SCHEMBL13161955 | 0.75 | ABL1 (0.46) | LMNACNR2HPGDSSMN1; SMN2TSHR | |
| SCHEMBL13373365 | 0.74 | HTT (0.47) | LMNACNR2SMN1; SMN2 | |
| SCHEMBL24512956 | 0.73 | NPC1 (0.42) | NPC1LMNASMYD3EPHX1SMN1; SMN2 | |
| SCHEMBL1871362 | 0.72 | RAB9A (0.46) | NPC1SMN1; SMN2RAB9AKMT2A | |
| SCHEMBL13162001 | 0.71 | NPC1 (0.55) | NPC1LMNASMN1; SMN2TSHRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-8288425-B2 | Benzimidazoles | AVENTIS PHARMACEUTICALS INC. (US) | 2012-10-16 | — | — | US | disclosed |