Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | CDC42 | P60953 | 1/20 | 0.43 |
| ▸ | RAC1 | P63000 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4740861 | 0.82 | TNF (0.50) | MEN1KMT2AACHENPC1 | |
| SCHEMBL5164752 | 0.78 | HTR2A (0.47) | MEN1KMT2ATSHRNPC1POLB | |
| SCHEMBL1119908 | 0.78 | KMT2A (0.49) | ABCB11MEN1KMT2A | |
| SCHEMBL4739767 | 0.75 | UTS2R (0.42) | RXFP1CYP1A2TSHRPOLB | |
| SCHEMBL3978356 | 0.73 | UGT2B7 (0.43) | MEN1KMT2ACYP1A2TSHRACHE | |
| SCHEMBL17073799 | 0.72 | TSHR (0.51) | ABCB11MEN1KMT2AAKR1C3AKR1C2 | |
| SCHEMBL8075567 | 0.71 | ABCB11 (0.48) | ABCB11MEN1KMT2AAKR1C3AKR1C2 | |
| SCHEMBL6091855 | 0.71 | AOC3 (0.50) | MEN1KMT2ACYP1A2TSHR | |
| SCHEMBL13986008 | 0.70 | SLC6A2 (0.53) | MEN1KMT2ATSHRACHENPC1 | |
| SCHEMBL9050772 | 0.70 | ABCB11 (0.59) | ABCB11AKR1C3AKR1C2PTGS1AKR1C1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008081477-A1 | 3-ARYLOXY 3-SUBSTITUTED PROPANAMINES | NATCO PHARMA LIMITED (IN) | 2008-07-10 | — | — | WO | disclosed |