Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 9/20 | 0.51 |
| ▸ | HSF1 | Q00613 | 6/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MPI | P34949 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | GALK1 | P51570 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | RIN1 | Q13671 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.35 |
| ▸ | RAF1 | P04049 | 2/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3473787 | 0.86 | TDP2 (0.51) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL3473513 | 0.83 | TDP2 (0.54) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL3471924 | 0.73 | TDP2 (0.85) | TDP2KDM4CNPC1ABL1POLB | |
| SCHEMBL3474651 | 0.72 | TDP2 (0.47) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL13273085 | 0.72 | HSF1 (0.40) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL3472830 | 0.68 | TDP2 (0.43) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL3472094 | 0.68 | TDP2 (0.43) | TDP2HSF1KDM4CNPC1ABL1 | |
| SCHEMBL13492890 | 0.63 | TDP2 (0.55) | TDP2HSF1KDM4CNPC1POLB | |
| SCHEMBL3475005 | 0.62 | TDP2 (0.56) | TDP2HSF1KDM4CNPC1POLB | |
| SCHEMBL3471256 | 0.61 | HSF1 (0.54) | TDP2HSF1KDM4CNPC1ABL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010072807-A2 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2010-07-01 | — | — | WO | claimed |
| WO-2010072807-A2 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2010-07-01 | — | — | WO | disclosed |
| WO-2010072807-A2 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2010-07-01 | — | — | WO | disclosed |