Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 1/20 | 0.39 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | DRD4 | P21917 | 4/20 | 0.35 |
| ▸ | DRD3 | P35462 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.35 |
| ▸ | PLK2 | Q9NYY3 | 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 | |
|---|---|---|---|---|
| SCHEMBL5243944 | 0.97 | SMPD1 (0.39) | SMPD1ACKR3BRD4TP53MEN1 | |
| SCHEMBL5247607 | 0.92 | KMT2A (0.43) | ACKR3TP53NPC1RAB9AMEN1 | |
| SCHEMBL5250802 | 0.92 | SMPD1 (0.38) | SMPD1ACKR3BRD4TP53MEN1 | |
| SCHEMBL5244405 | 0.92 | KMT2A (0.38) | SMPD1ACKR3BRD4TP53NPC1 | |
| SCHEMBL5244829 | 0.92 | BRD4 (0.37) | SMPD1ACKR3BRD4TP53MEN1 | |
| SCHEMBL5247507 | 0.90 | SMPD1 (0.38) | SMPD1ACKR3BRD4TP53KMT2A | |
| SCHEMBL5248452 | 0.90 | BRD4 (0.36) | SMPD1ACKR3BRD4TP53 | |
| SCHEMBL5248477 | 0.90 | BRD4 (0.47) | BRD4POLBTP53NPC1RAB9A | |
| SCHEMBL5244268 | 0.89 | PDK2 (0.35) | SMPD1ACKR3POLBDRD2DRD4 | |
| SCHEMBL5248542 | 0.89 | BRD4 (0.36) | SMPD1ACKR3BRD4POLBTP53 |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |