Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CTRB1 | P17538 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
| ▸ | ACE | P12821 | 1/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8538582 | 1.00 | NPC1 (0.45) | NPC1RAB9ACTRB1MEN1KMT2A | |
| SCHEMBL4340260 | 0.88 | NPC1 (0.47) | NPC1RAB9ACTRB1NPSR1MMP1 | |
| SCHEMBL4332764 | 0.84 | NPC1 (0.50) | NPC1RAB9ACTRB1MEN1KMT2A | |
| SCHEMBL4339763 | 0.83 | NPC1 (0.49) | NPC1RAB9ACTRB1MMEALDH1A1 | |
| SCHEMBL4520907 | 0.78 | ATM (0.60) | MEN1KMT2ANPSR1ACEALDH1A1 | |
| SCHEMBL1153904 | 0.77 | CTRB1 (0.43) | NPC1RAB9ACTRB1MEN1KMT2A | |
| SCHEMBL11737394 | 0.76 | NPSR1 (0.69) | NPSR1MMEACEACE2 | |
| SCHEMBL11737401 | 0.76 | NPSR1 (0.69) | NPSR1MMEACEACE2 | |
| SCHEMBL4340014 | 0.75 | NPSR1 (0.48) | NPC1RAB9ACTRB1NPSR1MME | |
| SCHEMBL4330855 | 0.75 | NPSR1 (0.44) | NPC1RAB9ACTRB1NPSR1MMP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5801249-A | Chiral auxiliaries | OXFORD ASYMMETRY INTERNATIONAL PLC (GB) | 1998-09-01 | — | — | US | disclosed |