Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.44 |
| ▸ | TUBB | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.44 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.44 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.44 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16273441 | 0.76 | MEN1 (0.54) | MAOAMAOBCA12KDRCA9 | |
| SCHEMBL14567100 | 0.75 | PTGS2 (0.63) | PTGS2MAOAMAOBMAPTALDH1A1 | |
| SCHEMBL16273447 | 0.70 | EGFR (0.53) | PTGS2MAOAMAOBMAPTALDH1A1 | |
| SCHEMBL16273442 | 0.69 | MEN1 (0.54) | PTGS2MAOAMAOBMAPTALDH1A1 | |
| SCHEMBL16273454 | 0.68 | SIRT5 (0.55) | PTGS2MAPTALDH1A1GAANPC1 | |
| SCHEMBL14865149 | 0.67 | PTGS2 (0.69) | PTGS2MAOAMAOBTUBB4ATUBB | |
| SCHEMBL12046921 | 0.66 | PTGS2 (0.65) | PTGS2MAOAMAOBTUBB4ATUBB | |
| SCHEMBL22953101 | 0.66 | CA9 (0.44) | MAOAMAOBCA12KDRCA9 | |
| SCHEMBL8245332 | 0.66 | PTGS2 (0.64) | PTGS2MAOAMAOBGSTO1MAPT | |
| SCHEMBL28199635 | 0.65 | RAB9A (0.72) | PTGS2GSTO1MAPTALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2766355-B1 | PYRAZOL-3-ONES THAT ACTIVATE PRO-APOPTOTIC BAX | DANA FARBER CANCER INST INC (US) | 2020-12-23 | — | — | EP | disclosed |