Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.33 |
| ▸ | PLA2G5 | P39877 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8591963 | 0.86 | ALDH1A1 (0.38) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL2448755 | 0.86 | ALDH1A1 (0.38) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL5077756 | 0.85 | ALDH1A1 (0.42) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL7806878 | 0.83 | ALDH1A1 (0.38) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL27316477 | 0.82 | ATM (0.39) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL1759122 | 0.80 | ALDH1A1 (0.44) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL3059935 | 0.80 | ALDH1A1 (0.44) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL22043916 | 0.80 | NR4A2 (0.33) | CHRNB2CHRNA4CTSLCTSBCTSS | |
| SCHEMBL27060622 | 0.80 | NR4A2 (0.33) | CHRNB2CHRNA4CTSLCTSBCTSS | |
| SCHEMBL30890495 | 0.79 | PLA2G2A (0.36) | ALDH1A1HPGDPLA2G2APLA2G5CTSL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0934291-A4 | — | SMITHKLINE BEECHAM CORP (US) | 1999-08-11 | — | — | EP | disclosed |
| EP-0934291-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-08-11 | — | — | EP | disclosed |
| WO-1997016433-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-05-09 | — | — | WO | disclosed |