Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | GALR2 | O43603 | 1/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.48 |
| ▸ | CCR6 | P51684 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL988023 | 0.90 | ALDH1A1 (0.60) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL988786 | 0.90 | ALDH1A1 (0.60) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL11086969 | 0.84 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2HPGDNPSR1LMNA | |
| SCHEMBL4623724 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL5203871 | 0.80 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL988312 | 0.80 | LMNA (0.50) | SMN1; SMN2LMNAPOLBCCR6KMT2A | |
| SCHEMBL11767621 | 0.79 | KDM4E (0.70) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL11858419 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KDM4ESMN1; SMN2HPGDNPSR1 | |
| SCHEMBL1251501 | 0.79 | ALDH1A1 (0.67) | ALDH1A1KDM4ESMN1; SMN2HPGDLMNA | |
| SCHEMBL8699013 | 0.79 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2HPGDLMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011008788-A1 | FLUORO-SUBSTITUTED COMPOUNDS AS KINASE INHIBITORS AND METHODS OF USE THEREOF | ZHANG DAWEI (US) | 2011-01-20 | — | — | WO | disclosed |
| WO-2011008788-A1 | FLUORO-SUBSTITUTED COMPOUNDS AS KINASE INHIBITORS AND METHODS OF USE THEREOF | ZHANG DAWEI (US) | 2011-01-20 | — | — | WO | disclosed |