Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.57 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.57 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.57 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.56 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3647264 | 0.91 | ALDH1A1 (0.68) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL7162261 | 0.86 | ALDH1A1 (0.79) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL7662848 | 0.85 | RAB9A (0.81) | RAB9AALDH1A1KMT2ANPC1KDM4E | |
| SCHEMBL7165655 | 0.85 | ALDH1A1 (0.77) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL6816359 | 0.84 | ALDH1A1 (0.67) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL7162285 | 0.81 | NPC1 (0.83) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL6816533 | 0.81 | SMN1; SMN2 (0.84) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL7161415 | 0.81 | MAPK1 (0.58) | MAPK1RAB9AALDH1A1KMT2ANPC1 | |
| SCHEMBL7716927 | 0.80 | PTPN2 (0.75) | RAB9AKMT2ANPC1KDM4EMAPT | |
| SCHEMBL23011774 | 0.80 | ALDH1A1 (0.84) | MAPK1RAB9AALDH1A1KMT2ANPC1 |
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-6555561-B2 | N-(5-((((5-Chloro-2,4-dimethoxyphenyl)amino)thioxomethyl)-amino)-2 -pyridinyl)-2-methylbenzamide, for example; inhibiting replication of a herpes virus | WYETH | 2003-04-29 | — | — | US | disclosed |