Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL11239647 | 1.00 | EGFR (0.44) | EGFRNPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL11239628 | 0.84 | LMNA (0.60) | EGFRLMNAAPPCA12CA7 | |
| SCHEMBL11239625 | 0.84 | LMNA (0.60) | EGFRLMNAAPPCA12CA7 | |
| SCHEMBL11229892 | 0.81 | CA12 (0.57) | EGFRAPPCA12CA7CA9 | |
| SCHEMBL11229891 | 0.81 | CA12 (0.57) | EGFRAPPCA12CA7CA9 | |
| SCHEMBL11246091 | 0.81 | FAAH (0.56) | EGFRLMNAALDH1A1CA12CA7 | |
| SCHEMBL11246098 | 0.81 | FAAH (0.56) | EGFRLMNAALDH1A1CA12CA7 | |
| SCHEMBL11238689 | 0.78 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL11236124 | 0.78 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL11239738 | 0.78 | EGFR (0.48) | EGFRLMNAAPPCA12CA7 |
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-4348399-A | Antiatherosclerotic and hypolipidemic 4-(monoalkylamino)phenyl alkane, alkene and alkyne carbinols, aldehydes, carboxylic acids and derivatives | AMERICAN CYANAMID COMPANY (US) | 1982-09-07 | — | — | US | disclosed |