Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.49 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20547656 | 0.92 | ALDH1A1 (0.54) | ALDH1A1RECQLLOXL2NPC1RAB9A | |
| SCHEMBL11020755 | 0.87 | TSHR (0.62) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL6923298 | 0.86 | CA1 (0.59) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL11191634 | 0.84 | NPC1 (0.62) | ALDH1A1RECQLLOXL2NPC1RAB9A | |
| SCHEMBL1505244 | 0.82 | LOXL2 (0.48) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL936391 | 0.81 | LOXL2 (0.47) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL1505193 | 0.80 | LOXL2 (0.56) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL1505243 | 0.80 | LOXL2 (0.56) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL31346174 | 0.80 | LOXL2 (0.56) | ALDH1A1LOXL2NPC1RAB9AHPGD | |
| SCHEMBL3042794 | 0.80 | LOXL2 (0.56) | ALDH1A1LOXL2NPC1RAB9AHPGD |
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-2011009484-A1 | ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS | NOVARTIS AG (CH) | 2011-01-27 | — | — | WO | disclosed |
| WO-2011009484-A1 | ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS | NOVARTIS AG (CH) | 2011-01-27 | — | — | WO | disclosed |