Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.51 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17376723 | 0.87 | MEN1 (0.70) | MEN1KMT2ATDP1POLBALDH1A1 | |
| SCHEMBL11590379 | 0.85 | KMT2A (0.74) | MEN1KMT2ATDP1POLBALDH1A1 | |
| SCHEMBL30030085 | 0.85 | KMT2A (0.74) | MEN1KMT2ATDP1POLBALDH1A1 | |
| SCHEMBL1961258 | 0.81 | FADS1 (0.69) | MEN1KMT2APOLBTHRBALDH1A1 | |
| Benodanil SCHEMBL18736 | 0.80 | MEN1 (1.00) | MEN1KMT2ATDP1POLBALDH1A1 | |
| Benodanil SCHEMBL29402073 | 0.80 | MEN1 (1.00) | MEN1KMT2ATDP1POLBALDH1A1 | |
| SCHEMBL28608407 | 0.80 | RAB9A (0.68) | MEN1KMT2APOLBP2RX1TMPRSS4 | |
| SCHEMBL1496329 | 0.80 | MEN1 (0.60) | MEN1KMT2ATDP1POLBTHRB | |
| SCHEMBL6811221 | 0.78 | MEN1 (0.74) | MEN1KMT2ATDP1POLBALDH1A1 | |
| SCHEMBL28493350 | 0.78 | ALDH1A1 (0.68) | MEN1KMT2ATDP1ALDH1A1MAPT |
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-104163799-B | 3-amino-4-Cyanoisoquinoline-1(2H) preparation method of-one derivant | 苏州大学 | 2016-08-17 | — | — | CN | disclosed |