Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 9/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10885368 | 0.82 | EPHX1 (0.46) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL20125270 | 0.77 | EPHX1 (0.55) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL19426060 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL1067515 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL8393998 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL15700754 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL19426065 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL17169490 | 0.72 | EPHX1 (0.63) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3927000 | 0.70 | EPHX1 (0.61) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2869853 | 0.70 | EPHX1 (0.56) | EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0086492-B1 | N-((ALKYLAMINO)CARBONYL)-N-(((ALKYLAMINO)-CARBONYL)OXY)ACYLAMIDES WITH ANTINEOPLASTIC ACTIVITY | THE DOW CHEMICAL COMPANY (US) | 1986-09-10 | — | — | EP | disclosed |
| US-4413009-A | N-((Alkylamino)carbonyl)-N-(((alkylamino)carbonyl)oxy)acylamides with antineoplastic activity | THE DOW CHEMICAL COMPANY (US) | 1983-11-01 | — | — | US | disclosed |
| EP-0086492-A2 | N-((alkylamino)carbonyl)-N-(((alkylamino)-carbonyl)oxy)acylamides with antineoplastic activity | THE DOW CHEMICAL COMPANY (US) | 1983-08-24 | — | — | EP | disclosed |