Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLQ | O75417 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.31 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8049583 | 0.99 | POLQ (0.35) | POLQKIF11LTC4SALDH1A1CHUK | |
| SCHEMBL8050015 | 0.91 | POLQ (0.35) | POLQKIF11LTC4SALDH1A1RORC | |
| Hydrochloric Acid SCHEMBL8056440 | 0.90 | POLQ (0.35) | POLQKIF11LTC4SRORCCYP19A1 | |
| SCHEMBL8056490 | 0.85 | POLQ (0.36) | POLQKIF11CHUKMAOAMAOB | |
| Hydrochloric Acid SCHEMBL8050511 | 0.84 | POLQ (0.35) | POLQKIF11CHUKMAOAMAOB | |
| SCHEMBL8051689 | 0.81 | GAK (0.40) | POLQKIF11CHUKMAOAMAOB | |
| Hydrochloric Acid SCHEMBL8050875 | 0.80 | GAK (0.39) | POLQKIF11CHUKMAOAMAOB | |
| SCHEMBL8051666 | 0.79 | ALDH1A1 (0.37) | ALDH1A1CYP11B1CYP11B2SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL8054087 | 0.78 | ALDH1A1 (0.36) | ALDH1A1CYP11B1CYP11B2SLC6A2SLC6A4 | |
| SCHEMBL8038767 | 0.78 | POLQ (0.37) | POLQKIF11CHUKMAOAMAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6022880-A | Substituted pyridylamino indoles | HOECHST MARION ROUSSEL, INC. (US) | 2000-02-08 | — | — | US | disclosed |
| US-5328920-A | Alleviating memory dysfunctions | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-07-12 | — | — | US | disclosed |