Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | IP6K1 | Q92551 | 11/20 | 0.56 |
| ▸ | IP6K2 | Q9UHH9 | 8/20 | 0.56 |
| ▸ | IP6K3 | Q96PC2 | 7/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10396641 | 0.88 | IP6K1 (0.50) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL9926035 | 0.87 | IP6K1 (0.64) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL10396642 | 0.84 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL10396913 | 0.81 | IP6K1 (0.47) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL10395913 | 0.81 | IP6K1 (0.63) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL10397001 | 0.81 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL10396386 | 0.80 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| Methane SCHEMBL10396634 | 0.80 | IP6K1 (0.62) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| Methane SCHEMBL10396789 | 0.80 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 | |
| SCHEMBL4019162 | 0.79 | MEN1 (0.66) | ALDH1A1SMN1; SMN2HPGDIP6K1IP6K2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4898874-A | Acetic acid derivatives of 3-aryl-2,1-benzisoxazole and esters and amides thereof | A. H. ROBINS COMPANY, INC. (US) | 1990-02-06 | — | — | US | disclosed |
| EP-0260924-A1 | Antiinflammatory derivatives of 3-aryl-2,1-benzisoxazole | A.H. ROBINS COMPANY, INCORPORATED (US) | 1988-03-23 | — | — | EP | disclosed |