Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 5/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.37 |
| ▸ | RHEB | Q15382 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11903484 | 0.91 | PDE10A (0.49) | GRIN1GRIN2BPDE10ACACNA1BTRPV1 | |
| Hydrochloric Acid SCHEMBL11903470 | 0.81 | GRIN1 (0.47) | GRIN1GRIN2BPDE10APOLBNPC1 | |
| Hydrochloric Acid SCHEMBL11903446 | 0.80 | GRIN1 (0.52) | GRIN1GRIN2BPDE10APOLBNPC1 | |
| Hydrochloric Acid SCHEMBL11903592 | 0.79 | GAA (0.56) | GRIN1GRIN2BPDE10APOLBNPC1 | |
| SCHEMBL14837228 | 0.77 | GRIN1 (0.48) | GRIN1GRIN2BPDE10APOLBNPC1 | |
| SCHEMBL23389133 | 0.76 | PDE10A (0.46) | PDE10ANPC1LMNARAB9ASMN1; SMN2 | |
| SCHEMBL10284435 | 0.76 | DDAH1 (0.49) | PDE10ATRPV1GAAKDM4EKMT2A | |
| SCHEMBL11903491 | 0.76 | RHEB (0.50) | PDE10ANPC1LMNARAB9ASMN1; SMN2 | |
| SCHEMBL14837303 | 0.76 | GRIN1 (0.47) | GRIN1GRIN2BPDE10APOLBNPC1 | |
| SCHEMBL14836680 | 0.76 | CNR2 (0.47) | GRIN1GRIN2BPOLBNPC1LMNA |
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-8293780-B1 | Anti-cancer agents based on 6-trifluoromethoxybenzimidazole derivatives and method of making | U.S. DEPARTMENT OF ENERGY (US) | 2012-10-23 | — | — | US | disclosed |
| US-8242284-B1 | Anti-cancer agents based on 6-trifluoromethoxybenzimidazole derivatives and method of making | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 2012-08-14 | — | — | US | disclosed |