Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 8/20 | 0.52 |
| ▸ | MAPK9 | P45984 | 8/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8043339 | 0.88 | NPC1 (0.52) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8046047 | 0.85 | NPC1 (0.53) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8032939 | 0.85 | NPC1 (0.47) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8033453 | 0.83 | NPC1 (0.58) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8050061 | 0.82 | NPC1 (0.45) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8714264 | 0.81 | CYP2C19 (0.43) | MAPK8MAPK9MEN1KMT2AALDH1A1 | |
| SCHEMBL8050212 | 0.80 | RAB9A (0.60) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8716288 | 0.80 | CYP2C19 (0.47) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL8042307 | 0.79 | MAPK8 (0.52) | MAPK8MAPK9NPC1RAB9ATLR9 | |
| SCHEMBL8051088 | 0.79 | NPC1 (0.45) | MAPK8MAPK9NPC1RAB9ATLR9 |
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-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |