Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | HSPA8 | P11142 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7114052 | 0.92 | HDAC6 (0.49) | HDAC6MCHR1TRPV4EGFRHSPA8 | |
| SCHEMBL7742258 | 0.84 | HDAC6 (0.57) | HDAC6HSPA8HTR3A | |
| SCHEMBL7739725 | 0.84 | CYP11B2 (0.38) | EGFRCYP11B2HSPA8CYP11B1HTR3A | |
| SCHEMBL7119690 | 0.82 | HDAC6 (0.60) | HDAC6TRPV4HSPA8 | |
| SCHEMBL7115561 | 0.82 | HDAC6 (0.60) | HDAC6TRPV4HSPA8IDH1 | |
| SCHEMBL7738034 | 0.81 | HDAC6 (0.56) | HDAC6CYP11B2HSPA8CYP11B1 | |
| SCHEMBL7733484 | 0.81 | HDAC6 (0.49) | HDAC6TRPV4CYP11B2HSPA8IDH1 | |
| SCHEMBL7117206 | 0.80 | HDAC6 (0.48) | HDAC6MCHR1TRPV4IDH1 | |
| SCHEMBL7215020 | 0.79 | HDAC6 (0.74) | HDAC6TRPV4HSPA8 | |
| SCHEMBL10308324 | 0.79 | HDAC6 (0.74) | HDAC6TRPV4HSPA8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0970100-B1 | BENZIMIDAZOLE DERIVATIVES | GLAXO GROUP LTD (GB) | 2003-11-12 | — | — | EP | claimed |
| US-6413938-B1 | HERPES VIRUS | THE REGENTS OF THE UNIVERSITY OF MICHIGAN | 2002-07-02 | — | — | US | claimed |
| EP-0970100-B1 | BENZIMIDAZOLE DERIVATIVES | GLAXO GROUP LTD (GB) | 2003-11-12 | — | — | EP | disclosed |
| US-6413938-B1 | HERPES VIRUS | THE REGENTS OF THE UNIVERSITY OF MICHIGAN | 2002-07-02 | — | — | US | disclosed |