Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 3/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.37 |
| ▸ | ERN1 | O75460 | 2/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.36 |
| ▸ | TUBB | P07437 | 2/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL499030 | 0.79 | ALOX5 (0.51) | CYP1A1CYP1B1ERN1TUBB1CYP1A2 | |
| SCHEMBL6248594 | 0.77 | APP (0.46) | CYP1A1CYP1B1ERN1CYP1A2ABCG2 | |
| SCHEMBL1635497 | 0.73 | CYP1A1 (0.42) | CYP1A1CYP1B1ERN1ABCG2PTGS2 | |
| SCHEMBL1635863 | 0.72 | PTGS2 (0.37) | CYP1A1CYP1B1ERN1MAOAABCG2 | |
| SCHEMBL1636058 | 0.72 | CYP1A1 (0.41) | CYP1A1CYP1B1ERN1ABCG2PTGS2 | |
| SCHEMBL1634113 | 0.71 | LMNA (0.44) | CYP1A1CYP1B1TUBB4ATUBBTUBA3C | |
| SCHEMBL5187642 | 0.71 | ERN1 (0.52) | CYP1A1CYP1B1ERN1CYP1A2MAOA | |
| SCHEMBL4295651 | 0.70 | PTGS2 (0.37) | CYP1A1CYP1B1ERN1ABCG2PTGS2 | |
| SCHEMBL4627782 | 0.70 | CYP1A1 (0.40) | CYP1A1CYP1B1ABCG2PTGS2ALDH1A1 | |
| SCHEMBL4295871 | 0.70 | PTGS2 (0.37) | CYP1A1CYP1B1ERN1ABCG2PTGS2 |
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-2005065074-A2 | PROTECTION OF TISSUES AND CELLS FROM CYTOTOXIC EFFECTS OF IONIZING RADIATION BY ABL INHIBITORS | TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2005-07-21 | — | — | WO | claimed |