Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 11/20 | 0.56 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | STAT3 | P40763 | 1/20 | 0.48 |
| ▸ | STAT1 | P42224 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8650721 | 0.92 | ALDH1A1 (0.56) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL891863 | 0.81 | S1PR3 (0.65) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL892137 | 0.79 | S1PR3 (0.62) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL21831291 | 0.78 | TSHR (0.57) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL27829721 | 0.77 | PBRM1 (0.47) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL28856869 | 0.77 | S1PR3 (0.58) | S1PR3S1PR1RAB9ANPC1STAT3 | |
| SCHEMBL21317622 | 0.76 | S1PR3 (0.63) | S1PR3S1PR1RAB9ANPC1PSMB8 | |
| SCHEMBL2799191 | 0.76 | S1PR3 (0.63) | S1PR3S1PR1RAB9ANPC1PSMB8 | |
| SCHEMBL22554186 | 0.76 | S1PR3 (0.62) | S1PR3S1PR1RAB9ANPC1ALDH1A1 | |
| SCHEMBL17619253 | 0.74 | S1PR3 (0.60) | S1PR3S1PR1RAB9ANPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113149926-B | Preparation method of 3, 5-disubstituted isoxazole derivative | 华侨大学 | 2023-05-26 | — | — | CN | disclosed |