Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 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 SCHEMBL8052586 | 0.99 | SMN1; SMN2 (0.31) | SMN1; SMN2ALDH1A1ATM | |
| SCHEMBL8053626 | 0.84 | SLC6A2 (0.39) | SMN1; SMN2ADRA2ACYP1A2LMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL8051780 | 0.83 | SLC6A2 (0.39) | SMN1; SMN2ADRA2ACYP1A2LMNACYP3A4 | |
| SCHEMBL8051650 | 0.83 | PRKCI (0.32) | SMN1; SMN2ALDH1A1ATMADRA2ACYP1A2 | |
| Hydrochloric Acid SCHEMBL8051670 | 0.82 | LIMK1 (0.33) | SMN1; SMN2ALDH1A1ATMADRA2ACYP1A2 | |
| SCHEMBL8050534 | 0.76 | ROCK1 (0.35) | SLC6A2 | |
| Hydrochloric Acid SCHEMBL8056254 | 0.75 | ROCK1 (0.34) | SLC6A2 | |
| SCHEMBL8050574 | 0.72 | CYP19A1 (0.32) | LMNA | |
| Hydrochloric Acid SCHEMBL8050310 | 0.71 | CYP19A1 (0.31) | LMNA | |
| SCHEMBL8054066 | 0.71 | DRD2 (0.37) | SMN1; SMN2ALDH1A1LMNAHTR1ADRD3 |
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 |