Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.35 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.35 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.35 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL366851 | 0.93 | ALDH1A1 (0.38) | S1PR3LTB4RLTB4R2SIGMAR1ALDH1A1 | |
| SCHEMBL366612 | 0.93 | ACHE (0.38) | ACHECYP11B1CYP11B2SCN9AS1PR3 | |
| SCHEMBL366900 | 0.91 | S1PR3 (0.39) | ACHES1PR3CNR2 | |
| SCHEMBL365169 | 0.91 | ACHE (0.41) | ACHELTB4RLTB4R2 | |
| SCHEMBL365006 | 0.91 | LTB4R (0.35) | ACHECYP11B1CYP11B2SCN9AS1PR3 | |
| SCHEMBL366751 | 0.88 | PPARG (0.33) | CYP11B1CYP11B2S1PR3ALKBH1ALDH1A1 | |
| SCHEMBL366080 | 0.86 | ALDH1A1 (0.38) | ACHECYP11B1CYP11B2SCN9AALDH1A1 | |
| SCHEMBL366374 | 0.85 | ALDH1A1 (0.38) | ACHESIGMAR1ALDH1A1CNR2 | |
| SCHEMBL367734 | 0.85 | ATM (0.40) | NCEH1ALDH1A1 | |
| SCHEMBL365593 | 0.84 | MRGPRX4 (0.39) | ACHELTB4RLTB4R2ALKBH1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |