Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRB | O95718 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESRRA | P11474 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | GMNN | O75496 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL13243228 | 0.89 | ESRRB (0.59) | ESRRBESR1ESRRAESR2ACHE | |
| SCHEMBL13893908 | 0.86 | ESR1 (0.58) | ESRRBESR1ESRRAESR2ACHE | |
| SCHEMBL20869723 | 0.84 | ESR1 (0.78) | ESRRBESR1ESRRAESR2HPGD | |
| SCHEMBL30028973 | 0.81 | ALDH1A1 (0.61) | ACHEHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL10944758 | 0.81 | ALDH1A1 (0.61) | ACHEHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL17463551 | 0.79 | ACACA (0.65) | ACHEHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL12443218 | 0.78 | ACHE (0.57) | ACHEHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL483736 | 0.78 | ACHE (0.57) | ACHEHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL16921273 | 0.77 | DHODH (0.80) | HPGDALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL7050208 | 0.76 | BACE1 (0.61) | ACHEHPGDALDH1A1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017184547-A1 | QUINOLINE COMPOUNDS AS MODULATORS OF RAGE ACTIVITY AND USES THEREOF | NEW YORK UNIVERSITY (US) | 2017-10-26 | — | — | WO | disclosed |