Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CDH1 | P12830 | 1/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL11280000 | 0.81 | NPC1 (0.53) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL9564438 | 0.81 | RAB9A (0.58) | SMN1; SMN2NPC1RAB9AMAPTHPGD | |
| SCHEMBL10874711 | 0.80 | EPHX2 (0.63) | SMN1; SMN2NPC1RAB9AMAPTTHRB | |
| SCHEMBL8375508 | 0.77 | NOTUM (0.57) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL14541437 | 0.76 | NOTUM (0.70) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| Acetic Acid Methyl Ester SCHEMBL9550215 | 0.74 | CDH1 (0.50) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL7904001 | 0.73 | MAPT (0.64) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL11902664 | 0.72 | NPC1 (0.51) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL30020309 | 0.72 | NOTUM (0.51) | SMN1; SMN2NOTUMNPC1RAB9AMAPT | |
| SCHEMBL9564346 | 0.71 | ALDH1A1 (0.39) | SMN1; SMN2MAPTTDP1HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0181018-A2 | Anticoccidial isoxazoles and compositions containing them | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-05-14 | — | — | EP | disclosed |