Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 8/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | ACP1 | P24666 | 1/20 | 0.39 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17028384 | 0.80 | LMNA (0.53) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL17658995 | 0.80 | ALOX5 (0.58) | MRGPRX4NPC1RAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL8693136 | 0.79 | MAOB (0.59) | — | |
| SCHEMBL8693129 | 0.77 | MAPT (0.51) | SLC6A4HTR2CHTR2B | |
| SCHEMBL27569179 | 0.75 | MRGPRX4 (0.51) | MRGPRX4NPC1RAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL4986557 | 0.75 | NPC1 (0.52) | MRGPRX4NPC1RAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL12735894 | 0.74 | HTR2C (0.59) | SLC6A4HTR2CHTR2B | |
| SCHEMBL13047045 | 0.74 | MRGPRX4 (0.52) | MRGPRX4NPC1RAB9ASMN1; SMN2NFKB1 | |
| Hydrochloric Acid SCHEMBL1532747 | 0.73 | HTR2C (0.58) | SLC6A4HTR2CHTR2B | |
| SCHEMBL10914926 | 0.73 | MRGPRX4 (0.58) | MRGPRX4NPC1RAB9ASMN1; SMN2NFKB1 |
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-4336267-A | Heart active compounds and methods of use | AKTIEBOLAGET HASSLE (SE) | 1982-06-22 | — | — | US | disclosed |
| US-4244969-A | (P-HYDROXYPHENOXY)PROPANOLAMINE DERIVATIVES USEFUL AS B-RECEPTOR STIMULANTS | AKTIEBOLAGET HASSLE (SE) | 1981-01-13 | — | — | US | disclosed |