Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 11/20 | 0.44 |
| ▸ | NPC1 | O15118 | 10/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10847822 | 0.89 | RAB9A (0.39) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10849346 | 0.81 | ALDH1A1 (0.42) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11214622 | 0.80 | ALDH1A1 (0.41) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10851145 | 0.80 | GAA (0.45) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10846141 | 0.77 | NPC1 (0.45) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10850376 | 0.72 | ALDH1A1 (0.44) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7721905 | 0.71 | L3MBTL1 (0.40) | ALDH1A1SMN1; SMN2POLBMAPTMAPK1 | |
| SCHEMBL18231175 | 0.70 | RAB9A (0.58) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL10849021 | 0.70 | RAB9A (0.50) | ALDH1A1NPSR1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL9033466 | 0.69 | RAB9A (0.49) | ALDH1A1NPSR1RAB9ANPC1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4622401-A | ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1986-11-11 | — | — | US | disclosed |
| EP-0070376-A1 | Heterocyclic substituted-amino-pyrazolines | AMERICAN CYANAMID COMPANY (US) | 1983-01-26 | — | — | EP | disclosed |