Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7407268 | 1.00 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2CYP2C19TSHRNPSR1 | |
| SCHEMBL11859333 | 0.97 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2NPSR1LMNAFFAR3 | |
| SCHEMBL17252177 | 0.90 | FFAR3 (0.32) | CYP2C19TSHRLMNAFFAR3 | |
| SCHEMBL13736831 | 0.86 | CYP2C19 (0.39) | ALDH1A1SMN1; SMN2CYP2C19TSHRUSP2 | |
| SCHEMBL28557040 | 0.86 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2CYP2C19TSHRUSP2 | |
| SCHEMBL15059605 | 0.86 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2CYP2C19TSHRUSP2 | |
| SCHEMBL762293 | 0.83 | — | — | |
| SCHEMBL10586224 | 0.82 | FFAR3 (0.39) | CYP2C19FFAR3 | |
| SCHEMBL13544764 | 0.80 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2LMNABLMKMT2A | |
| SCHEMBL11378685 | 0.80 | NPSR1 (0.47) | ALDH1A1SMN1; SMN2TSHRNPSR1LMNA |
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-2121570-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF ALDEHYDES AND KETONES | Dow Global Technologies Inc. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008076795-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF ALDEHYDES AND KETONES | DOW GLOBAL TECHNOLOGIES INC. (US) | 2008-06-26 | — | — | WO | disclosed |