Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14722144 | 1.00 | TSHR (0.37) | TSHRHDAC1HDAC8HDAC6HDAC3 | |
| SCHEMBL14721749 | 0.87 | TUBB4A (0.36) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14721747 | 0.87 | TUBB4A (0.36) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14721722 | 0.83 | TSHR (0.36) | TSHRRECQLSMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL14721726 | 0.83 | TSHR (0.36) | TSHRRECQLSMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL14722147 | 0.82 | HDAC1 (0.36) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14722146 | 0.82 | HDAC1 (0.36) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14725359 | 0.81 | HDAC3 (0.32) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14725385 | 0.81 | HDAC3 (0.32) | HDAC1HDAC8HDAC6HDAC3TUBB4A | |
| SCHEMBL14721210 | 0.81 | KDM4E (0.37) | TSHRSMN1; SMN2KMT2AMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013026942-A1 | TUBULIN BINDING AGENTS | THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) | 2013-02-28 | — | — | WO | disclosed |