Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPY2R | P49146 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GNRHR | P30968 | 1/20 | 0.37 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7732082 | 0.85 | MAPT (0.46) | ALDH1A1GAAMAPTSMN1; SMN2LMNA | |
| SCHEMBL6474949 | 0.82 | HTR1A (0.52) | ALDH1A1KDM4ECYP1A2CYP2D6HTR1A | |
| SCHEMBL7736593 | 0.81 | HTR1A (0.46) | ALDH1A1HTR1AGAAMAPTLMNA | |
| SCHEMBL27435293 | 0.73 | MAPT (0.50) | ALDH1A1KDM4EHTR1ANPY2RMAPT | |
| SCHEMBL7607947 | 0.72 | LMNA (0.51) | ALDH1A1HTR1AMAPTSMN1; SMN2LMNA | |
| SCHEMBL6930796 | 0.69 | DRD2 (0.59) | ALDH1A1KDM4EHTR1AMAPTSMN1; SMN2 | |
| SCHEMBL5884404 | 0.68 | KMT2A (0.46) | ALDH1A1KDM4ECYP1A2MAPTSMN1; SMN2 | |
| SCHEMBL6936851 | 0.67 | HTR1A (0.69) | ALDH1A1HTR1AMAPTSMN1; SMN2LMNA | |
| SCHEMBL7609804 | 0.67 | HTR1A (0.51) | ALDH1A1KDM4ECYP1A2CYP2D6HTR1A | |
| SCHEMBL6934208 | 0.66 | HTR1A (0.59) | ALDH1A1HTR1AMAPTSMN1; SMN2LMNA |
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-6399614-B1 | TREATING NEUROMUSCULAR DYSFUNCTION OF LOWER URINARY TRACT VIA PERIPHERAL OR CENTRAL NERVOUS SYSTEM; SEROTONIN RECEPTOR ANTAGONIST | RECORDATI S.A. CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 2002-06-04 | — | — | US | disclosed |