Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1189285 | 0.92 | ABCB1 (0.45) | ABCB1RORCALDH1A1SIGMAR1MAPT | |
| SCHEMBL2906426 | 0.90 | ABCB1 (0.44) | ABCB1RORCALDH1A1SIGMAR1MAPT | |
| SCHEMBL2906427 | 0.89 | ABCB1 (0.44) | ABCB1RORCALDH1A1SIGMAR1MAPT | |
| SCHEMBL15114465 | 0.81 | ALDH1A1 (0.45) | ABCB1ALDH1A1MAPTHPGDDDB1 | |
| SCHEMBL15079557 | 0.80 | ALDH1A1 (0.44) | RORCALDH1A1SIGMAR1MAPTHPGD | |
| SCHEMBL20582129 | 0.80 | ALDH1A1 (0.49) | ABCB1RORCALDH1A1SIGMAR1MAPT | |
| SCHEMBL15106342 | 0.79 | ALDH1A1 (0.51) | ALDH1A1NPC1RAB9ADDB1CRBN | |
| Hydrochloric Acid SCHEMBL30916058 | 0.78 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ADDB1CRBN | |
| SCHEMBL1188911 | 0.75 | CTSL (0.56) | ALDH1A1OPRK1CTSLCTSBCTSS | |
| SCHEMBL3991791 | 0.75 | ALDH1A1 (0.46) | ABCB1RORCALDH1A1SIGMAR1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2217226-A1 | PEPTIDE DEFORMYLASE INHIBITORS | GlaxoSmithKline LLC (US) | 2010-08-18 | — | — | EP | disclosed |
| WO-2009061879-A1 | PEPTIDE DEFORMYLASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-14 | — | — | WO | disclosed |