Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | SNCA | P37840 | 4/20 | 0.53 |
| ▸ | APP | P05067 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12614378 | 0.80 | KMT2A (0.54) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL27874411 | 0.77 | CNR2 (0.49) | ALDH1A1TDP1SMN1; SMN2TSHRHTT | |
| SCHEMBL27957392 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL9030278 | 0.76 | LMNA (0.61) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL274052 | 0.74 | KMT2A (0.63) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL6817343 | 0.74 | ALDH1A1 (0.58) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL9056926 | 0.74 | LMNA (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL28628922 | 0.73 | SMN1; SMN2 (0.61) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL25827703 | 0.72 | IMPDH2 (0.36) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL5622616 | 0.72 | SMN1; SMN2 (0.60) | ALDH1A1TDP1SMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102718694-A | 3-cyan substituted indole compound and synthetic method thereof | UNIV SHANGHAI | 2012-10-10 | — | — | CN | disclosed |