Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | CTSG | P08311 | 1/20 | 0.38 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.38 |
| ▸ | CMA1 | P23946 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6067580 | 0.81 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL6067721 | 0.79 | MAPT (0.40) | ALDH1A1SMN1; SMN2PRSS1CTSGCTRB1 | |
| SCHEMBL7617574 | 0.76 | NPSR1 (0.41) | SMN1; SMN2PRSS1CTSGCTRB1CMA1 | |
| SCHEMBL6067632 | 0.76 | MMP8 (0.49) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL3257459 | 0.74 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2KMT2AMAPTPOLB | |
| SCHEMBL7615614 | 0.73 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2KMT2AMAPTPOLB | |
| SCHEMBL6067692 | 0.73 | MAPT (0.31) | MAPT | |
| SCHEMBL6067718 | 0.73 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL7061795 | 0.73 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2MEN1KMT2AKEAP1 | |
| SCHEMBL7616402 | 0.72 | MAPT (0.41) | SMN1; SMN2PRSS1CTSGCTRB1CMA1 |
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-2006100606-A2 | PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION | WARNER-LAMBERT COMPANY LLC (US) | 2006-09-28 | — | — | WO | disclosed |