Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.41 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9507861 | 0.78 | SMN1; SMN2 (0.53) | ALDH1A1POLBNPC1RAB9ARECQL | |
| SCHEMBL11329582 | 0.78 | CES2 (0.58) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL13017375 | 0.75 | CES2 (0.60) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL8396774 | 0.74 | HPGD (0.50) | ALDH1A1NPC1RAB9AHPGDKMT2A | |
| SCHEMBL2632778 | 0.74 | CES2 (0.58) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL7241311 | 0.74 | CES2 (0.58) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL4957629 | 0.73 | CES2 (0.52) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL3877439 | 0.73 | NR4A1 (0.52) | ALDH1A1POLBNPC1RAB9ACYP1A2 | |
| SCHEMBL28300625 | 0.72 | CES2 (0.56) | CES2CES1ALDH1A1POLBNPC1 | |
| SCHEMBL7973356 | 0.72 | CES2 (0.50) | CES2CES1ALDH1A1POLBCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0348737-B1 | HETEROARYLOXY-ACETIC ACID N-ISOPROPYL ANILIDES | BAYER AG (DE) | 1993-08-04 | — | — | EP | claimed |