Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1L | O00429 | 2/20 | 0.53 |
| ▸ | KLK1 | P06870 | 5/20 | 0.51 |
| ▸ | KLKB1 | P03952 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | DRD4 | P21917 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL17503922 | 0.80 | KLK1 (0.68) | DNM1LKLK1KLKB1MEN1KMT2A | |
| SCHEMBL21875358 | 0.79 | DNM1L (0.73) | DNM1LKLKB1MEN1KMT2A | |
| SCHEMBL15875702 | 0.76 | KLK1 (0.55) | KLK1KLKB1 | |
| SCHEMBL15873870 | 0.74 | KLKB1 (0.68) | KLK1KLKB1 | |
| SCHEMBL17503944 | 0.74 | KLKB1 (0.68) | DNM1LKLK1KLKB1MEN1KMT2A | |
| SCHEMBL17503953 | 0.74 | KLKB1 (0.68) | DNM1LKLK1KLKB1MEN1KMT2A | |
| SCHEMBL19513363 | 0.71 | KLK1 (0.58) | KLK1KLKB1DRD2DRD4DRD3 | |
| SCHEMBL17503893 | 0.71 | DRD2 (0.60) | KLK1KLKB1MEN1KMT2ADRD2 | |
| SCHEMBL16246895 | 0.71 | MEN1 (0.51) | DNM1LKLKB1MEN1KMT2ADRD2 | |
| SCHEMBL16246855 | 0.71 | KLKB1 (0.67) | DNM1LKLK1KLKB1MEN1KMT2A |
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-105452240-B | Hete rocyclic derivatives | 卡尔维斯塔制药有限公司 | 2018-06-26 | — | — | CN | disclosed |