Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | PPIA | P62937 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | KLK7 | P49862 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10555782 | 0.86 | LTA4H (0.56) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL10600445 | 0.86 | ALDH1A1 (0.59) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL10598199 | 0.81 | ALDH1A1 (0.53) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL11017480 | 0.79 | KLK7 (0.52) | PPIAMAPTTP53MEN1KMT2A | |
| SCHEMBL14336343 | 0.77 | LTA4H (0.48) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL13555325 | 0.77 | LTA4H (0.48) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL3791341 | 0.77 | MGLL (0.72) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL11512691 | 0.76 | KMT2A (0.54) | ALDH1A1PPIAKDM4EMEN1KMT2A | |
| SCHEMBL9724967 | 0.76 | MAPT (0.67) | ALDH1A1PPIAKDM4EMAPTTP53 | |
| SCHEMBL11311282 | 0.76 | MEN1 (0.65) | ALDH1A1KDM4EMAPTTP53HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-20160171150-A1 | Chemical Modulators of Pro-Apoptotic BAX and BCL-2 Polypeptides | DANA-FARBER CANCER INSTITUTE, INC. | 2016-06-16 | — | — | US | disclosed |