Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5246036 | 0.91 | NPC1 (0.41) | BRD4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5246108 | 0.90 | BRD4 (0.47) | BRD4NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL5245521 | 0.89 | SMPD1 (0.41) | BRD4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5247900 | 0.89 | SMPD1 (0.44) | BRD4TP53DRD2DRD4DRD3 | |
| SCHEMBL5244720 | 0.89 | KMT2A (0.43) | KMT2ANPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL5243860 | 0.89 | SMPD1 (0.42) | BRD4TP53SMPD1 | |
| SCHEMBL5244569 | 0.88 | SMPD1 (0.41) | BRD4KMT2ATP53SMPD1 | |
| SCHEMBL5247618 | 0.88 | SMPD1 (0.43) | BRD4POLBTP53DRD2DRD4 | |
| SCHEMBL5245878 | 0.88 | BRD4 (0.42) | BRD4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5244512 | 0.87 | SMPD1 (0.42) | BRD4KMT2APOLBTP53DRD2 |
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 |