Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | FABP4 | P15090 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 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 | |
|---|---|---|---|---|
| SCHEMBL5318871 | 0.99 | PTGS1 (0.48) | PTGS1PTGS2HDAC6HDAC1HDAC10 | |
| SCHEMBL5319947 | 0.88 | CA1 (0.56) | HDAC6HDAC1HDAC10CA1CA2 | |
| SCHEMBL5319152 | 0.87 | CA1 (0.57) | HDAC6HDAC1HDAC10CA1CA2 | |
| SCHEMBL14467239 | 0.87 | CA1 (0.57) | HDAC6HDAC1HDAC10CA1CA2 | |
| SCHEMBL5340406 | 0.87 | CA1 (0.57) | HDAC6HDAC1HDAC10CA1CA2 | |
| SCHEMBL5322648 | 0.76 | PTPN1 (0.51) | HDAC6HDAC1HDAC10PTPN2PTPN1 | |
| SCHEMBL7464584 | 0.76 | CA1 (0.67) | PTGS1PTGS2HDAC6HDAC1HDAC10 | |
| SCHEMBL4106593 | 0.73 | PTPN1 (0.49) | HDAC6HDAC1PTPN2PTPN1HTT | |
| SCHEMBL5988010 | 0.73 | PTPN1 (0.49) | HDAC6HDAC1PTPN2PTPN1HTT | |
| SCHEMBL14467238 | 0.73 | CA1 (0.59) | HDAC6HDAC1HDAC10CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007081755-A2 | INDOLE-BENZIMIDAZOLE AND INDAZOLE INHIBITORS OF TYROSINE PHOSPHATASES | METABASIS THERAPEUTICS, INC. (US) | 2007-07-19 | — | — | WO | claimed |
| WO-2007081755-A2 | INDOLE-BENZIMIDAZOLE AND INDAZOLE INHIBITORS OF TYROSINE PHOSPHATASES | METABASIS THERAPEUTICS, INC. (US) | 2007-07-19 | — | — | WO | disclosed |