Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.53 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.47 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.46 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.46 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.46 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.46 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.46 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14189470 | 1.00 | KLK5 (0.53) | KLK5P2RX7PSEN1PSEN2APH1B | |
| SCHEMBL8685847 | 1.00 | KLK5 (0.53) | KLK5P2RX7PSEN1PSEN2APH1B | |
| SCHEMBL14209406 | 0.91 | KLK5 (0.46) | KLK5P2RX7PSEN1PSEN2APH1B | |
| SCHEMBL3348635 | 0.87 | ALDH1A1 (0.44) | KLK5P2RX7ATMALDH1A1TSHR | |
| SCHEMBL1258432 | 0.86 | ATM (0.56) | P2RX7APPATMALDH1A1TSHR | |
| SCHEMBL1258429 | 0.86 | ATM (0.56) | P2RX7APPATMALDH1A1TSHR | |
| SCHEMBL6562244 | 0.85 | KLK5 (0.59) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6814107 | 0.85 | KLK5 (0.59) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10209786 | 0.83 | ALDH1A1 (0.46) | KLK5P2RX7ATMALDH1A1TSHR | |
| SCHEMBL7275804 | 0.80 | CA2 (0.50) | KLK5ATMALDH1A1TSHRLMNA |
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-0970066-A1 | AMINOEPOXIDES FROM AMINOALDEHYDES AND IN-SITU FORMED HALOMETHYL ORGANOMETALLIC REAGENT | G.D. SEARLE & CO. (US) | 2000-01-12 | — | — | EP | disclosed |
| WO-1998029401-A1 | AMINOEPOXIDES FROM AMINOALDEHYDES AND IN-SITU FORMED HALOMETHYL ORGANOMETALLIC REAGENT | G.D. SEARLE & CO. (US) | 1998-07-09 | — | — | WO | disclosed |