Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 4/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9213944 | 0.79 | RAB9A (0.59) | NOTUMDRD2DRD4DRD3RAB9A | |
| SCHEMBL9220990 | 0.76 | PTGS2 (0.47) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL9212438 | 0.76 | RAB9A (0.56) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL7220962 | 0.76 | RAB9A (0.43) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL929198 | 0.75 | RAB9A (0.61) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL8288256 | 0.71 | NOTUM (0.70) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL7220731 | 0.71 | RAB9A (0.40) | NOTUMDRD2DRD4DRD3RAB9A | |
| SCHEMBL22925626 | 0.71 | S1PR1 (0.48) | NOTUMRAB9ANPC1MEN1KMT2A | |
| SCHEMBL9214731 | 0.71 | NPC1 (0.59) | RAB9ANPC1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL9219309 | 0.71 | MAPT (0.51) | RAB9ANPC1MEN1KMT2ASMN1; SMN2 |
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-6544982-B1 | 3-aryl-5-aminoisoxazole derivatives | MERCK & CO., INC. | 2003-04-08 | — | — | US | disclosed |