Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MPI | P34949 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.54 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7389213 | 0.87 | NPC1 (0.54) | KMT2AHTR1AADRA2ADRD2HTR2A | |
| SCHEMBL7390664 | 0.86 | HTR1A (0.53) | KMT2AHTR1AADRA2ACYP2D6DRD2 | |
| SCHEMBL7394120 | 0.86 | DRD2 (0.53) | KMT2AHTR1AADRA2ADRD2ADRA1A | |
| SCHEMBL7391863 | 0.86 | DRD2 (0.60) | KMT2AALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL7381746 | 0.86 | TSHR (0.64) | KMT2AHTR1AADRA2ACYP2D6DRD2 | |
| SCHEMBL7395417 | 0.86 | DRD2 (0.60) | KMT2AALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL7386508 | 0.85 | MAPT (0.61) | KMT2AALDH1A1LMNAMAPTHDAC1 | |
| SCHEMBL7390493 | 0.85 | MAPT (0.61) | KMT2AALDH1A1LMNAMAPTHDAC1 | |
| SCHEMBL7390501 | 0.85 | MAPT (0.61) | KMT2AALDH1A1LMNAMAPTHDAC1 | |
| SCHEMBL7392918 | 0.85 | NPC1 (0.56) | KMT2AHTR1AADRA2ADRD2HTR2A |
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-5864039-A | THERAPEUTIC TREATMENT OF VARIOUS GASTROINTESTINAL DISEASES, CENTRAL NERVOUS DISORDERS, CARDIOVASCULAR DISORDERS, URINARY DISEASES, UROGENITAL DISORDERS | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1999-01-26 | — | — | US | disclosed |
| EP-0873990-A1 | BENZOIC ACID COMPOUNDS AND MEDICINAL USE THEREOF | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1998-10-28 | — | — | EP | disclosed |