Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 16/20 | 0.62 |
| ▸ | BRD2 | P25440 | 5/20 | 0.62 |
| ▸ | CREBBP | Q92793 | 4/20 | 0.59 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.54 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12487 | 0.82 | NPC1 (0.69) | BRD4BRD2CREBBPNPC1POLB | |
| SCHEMBL12077969 | 0.82 | BRD4 (0.55) | BRD4BRD2CREBBPLMNA | |
| SCHEMBL980536 | 0.79 | MAP4K4 (0.76) | BRD4BRD2CREBBPNPC1POLB | |
| SCHEMBL13036108 | 0.79 | BRD4 (0.57) | BRD4BRD2CREBBPBRD3 | |
| SCHEMBL16246450 | 0.79 | BRD4 (0.62) | BRD4BRD2CREBBPNPC1POLB | |
| SCHEMBL9657290 | 0.79 | BRD4 (0.62) | BRD4BRD2CREBBPNPC1POLB | |
| SCHEMBL15330867 | 0.79 | BRD4 (0.58) | BRD4BRD2CREBBPNPC1POLB | |
| SCHEMBL16404607 | 0.78 | BRD4 (0.66) | BRD4BRD2LMNACLK4 | |
| SCHEMBL5714189 | 0.78 | BRD4 (0.61) | BRD4BRD2CREBBPNPC1POLB | |
| Hydrochloric Acid SCHEMBL1016039 | 0.78 | MAP4K4 (0.73) | BRD4BRD2CREBBPNPC1POLB |
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-2429993-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BOEHRINGER INGELHEIM INT (DE) | 2015-01-21 | — | — | EP | disclosed |