Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.35 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL134570 | 0.73 | IDO1 (0.46) | ALDH1A1TSHRNPSR1KMT2AGAA | |
| SCHEMBL3942966 | 0.73 | IDO1 (0.46) | ALDH1A1TSHRNPSR1KMT2AGAA | |
| SCHEMBL13209207 | 0.71 | GAA (0.44) | ALDH1A1TSHRNPSR1POLBKMT2A | |
| SCHEMBL3960842 | 0.71 | GAA (0.43) | ALDH1A1TSHRNPSR1POLBKMT2A | |
| SCHEMBL18706885 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TSHRNPSR1KMT2AGAA | |
| SCHEMBL12116657 | 0.71 | GAA (0.44) | ALDH1A1TSHRNPSR1POLBKMT2A | |
| SCHEMBL3773521 | 0.71 | GAA (0.44) | ALDH1A1TSHRNPSR1POLBKMT2A | |
| SCHEMBL20066346 | 0.71 | WDR5 (0.40) | KMT2AGAAABCC9KCNJ11NPC1 | |
| SCHEMBL9218676 | 0.70 | ALDH1A1 (0.40) | ALDH1A1NPSR1KMT2AGAACYP2C19 | |
| SCHEMBL9218679 | 0.70 | ALDH1A1 (0.40) | ALDH1A1NPSR1KMT2AGAACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2297140-A1 | NOVEL 1,2,4 OXADIAZOLE COMPOUNDS AND METHODS OF USE THEREOF | Abbott Laboratories (US) | 2011-03-23 | — | — | EP | disclosed |
| WO-2009148452-A1 | NOVEL 1,2,4 OXADIAZOLE COMPOUNDS AND METHODS OF USE THEREOF | ABBOTT LABORATORIES (US) | 2009-12-10 | — | — | WO | disclosed |