Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PEPD | P12955 | 2/20 | 0.40 |
| ▸ | FKBP1A | P62942 | 6/20 | 0.40 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | BIRC2 | Q13490 | 5/20 | 0.34 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | BIRC3 | Q13489 | 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 | |
|---|---|---|---|---|
| SCHEMBL8096010 | 0.99 | PEPD (0.41) | PEPDFKBP1AXPNPEP1LMNARAB9A | |
| SCHEMBL8246560 | 0.91 | FKBP1A (0.43) | PEPDFKBP1AALDH1A1POLB | |
| SCHEMBL9966624 | 0.85 | PEPD (0.41) | PEPDFKBP1AXPNPEP1 | |
| SCHEMBL8203043 | 0.82 | ALDH1A1 (0.38) | LMNARAB9AALDH1A1CYP3A4TSHR | |
| SCHEMBL1244162 | 0.80 | CASP1 (0.38) | LMNARAB9AALDH1A1CYP3A4TSHR | |
| SCHEMBL733205 | 0.80 | CASP1 (0.38) | LMNARAB9AALDH1A1CYP3A4TSHR | |
| SCHEMBL15692746 | 0.80 | PEPD (0.46) | PEPDFKBP1AXPNPEP1LMNARAB9A | |
| SCHEMBL23845229 | 0.79 | KLK5 (0.49) | PEPDFKBP1AXPNPEP1LMNARAB9A | |
| SCHEMBL731388 | 0.79 | CASP1 (0.36) | LMNARAB9ASMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL1244172 | 0.79 | CASP1 (0.36) | LMNARAB9ASMN1; SMN2ALDH1A1CYP3A4 |
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-2178902-B1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | ANGELETTI P IST RICHERCHE BIO (IT) | 2012-11-28 | — | — | EP | disclosed |