Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | PEPD | P12955 | 1/20 | 0.31 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL755185 | 1.00 | ATM (0.38) | ATMDPP4DPP8DPP9ACE | |
| SCHEMBL22360773 | 1.00 | ATM (0.38) | ATMDPP4DPP8DPP9ACE | |
| SCHEMBL17995266 | 1.00 | ATM (0.38) | ATMDPP4DPP8DPP9ACE | |
| Hydrochloric Acid SCHEMBL1493679 | 0.98 | ATM (0.37) | ATMDPP4DPP8DPP9ACE | |
| SCHEMBL13165479 | 0.83 | PIN1 (0.33) | ATMDPP4DPP8DPP9PIN1 | |
| SCHEMBL21515921 | 0.83 | PIN1 (0.33) | ATMDPP4DPP8DPP9PIN1 | |
| SCHEMBL8915827 | 0.83 | PIN1 (0.33) | ATMDPP4DPP8DPP9PIN1 | |
| SCHEMBL17641844 | 0.83 | PIN1 (0.33) | ATMDPP4DPP8DPP9PIN1 | |
| SCHEMBL10140519 | 0.81 | DPP4 (0.31) | DPP4DPP8DPP9PIN1PEPD | |
| SCHEMBL12861032 | 0.81 | PIN1 (0.41) | DPP4DPP8DPP9PIN1PEPD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017186147-A1 | BENZIMIDAZOLE-LINKED INDOLE COMPOUND ACTING AS NOVEL DIVALENT IAP ANTAGONIST | 南京明德新药研发股份有限公司 | 2017-11-02 | — | — | WO | disclosed |