Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9867513 | 0.80 | ADORA3 (0.36) | CYP2C9SMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL9868097 | 0.75 | CYP19A1 (0.58) | SMN1; SMN2NPC1RAB9ALMNATP53 | |
| SCHEMBL9865836 | 0.73 | CA2 (0.55) | CA2 | |
| SCHEMBL9866053 | 0.73 | CA2 (0.43) | CYP19A1MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL9867816 | 0.73 | HSD17B1 (0.46) | SMN1; SMN2NPC1RAB9ALMNATP53 | |
| SCHEMBL9867067 | 0.73 | ADORA3 (0.56) | SMN1; SMN2NPC1RAB9ALMNAPOLB | |
| SCHEMBL10976295 | 0.72 | CA2 (0.57) | LMNAKMT2AKDM4ETDP1CA1 | |
| SCHEMBL10913248 | 0.72 | CA2 (0.54) | CA1CA2CA12CA9CA14 | |
| SCHEMBL9866328 | 0.70 | NPC1 (0.49) | SMN1; SMN2NPC1RAB9ALMNAPOLB | |
| SCHEMBL9869169 | 0.70 | CA2 (0.47) | LMNATP53CYP19A1MAPTPTGS2 |
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-4985450-A | TREATMENT OF GLAUCOMA | AVENTIS PHARMACEUTICALS INC. | 1991-01-15 | — | — | US | disclosed |