Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | BIRC3 | Q13489 | 1/20 | 0.33 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.33 |
| ▸ | BIRC8 | Q96P09 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9609009 | 0.97 | F2 (0.36) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL14140109 | 0.92 | CYP3A4 (0.36) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL5832039 | 0.87 | XIAP (0.38) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL5832021 | 0.87 | XIAP (0.38) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL8358700 | 0.87 | XIAP (0.38) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL9609014 | 0.83 | ACE (0.40) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL10331862 | 0.83 | ACE (0.40) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL26256186 | 0.83 | ACE (0.40) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL12034318 | 0.83 | ACE (0.40) | XIAPCYP3A4TSHRTDP1MAPT | |
| SCHEMBL13259956 | 0.82 | F2 (0.38) | XIAPCYP3A4TSHRTDP1MAPT |
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-2019671-B1 | INTERMEDIATES FOR THE PREPARATION OF BIVALENT SMAC MIMETICS | UNIV MICHIGAN (US) | 2014-09-24 | — | — | EP | disclosed |