Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.40 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.40 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11620815 | 0.98 | HTR2C (0.49) | HTR2CHTR2BIDO1MAPTCYP3A4 | |
| SCHEMBL469033 | 0.80 | NCF1 (0.47) | HTR2CHTR2BMAPTCYP3A4HDAC1 | |
| SCHEMBL24715427 | 0.78 | CARM1 (0.49) | HTR2CHTR2BMAPTCYP3A4HDAC1 | |
| SCHEMBL10637678 | 0.78 | CARM1 (0.49) | HTR2CHTR2BMAPTCYP3A4HDAC1 | |
| SCHEMBL23124536 | 0.77 | HRH3 (0.65) | HTR2CHTR2BHDAC1HAO1HRH3 | |
| Hydrochloric Acid SCHEMBL27672266 | 0.77 | CARM1 (0.48) | HTR2CHTR2BMAPTCYP3A4HDAC1 | |
| SCHEMBL10232991 | 0.77 | HRH3 (0.44) | HTR2CHTR2BHDAC1HDAC8HDAC6 | |
| SCHEMBL5049395 | 0.75 | F2 (0.44) | HTR2CHTR2BMAPTHDAC1HDAC8 | |
| SCHEMBL13660206 | 0.75 | F2 (0.44) | HTR2CHTR2BMAPTHDAC1HDAC8 | |
| SCHEMBL22291710 | 0.75 | F2 (0.44) | HTR2CHTR2BMAPTHDAC1HDAC8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4076943-A | DIURETICS, SALURETICS, ANTIHYPERTENSIVES | BAYER AKTIENGESELLSCHAFT (DT) | 1978-02-28 | — | — | US | disclosed |
| US-4061653-A | DIURETIC, SALURETIC, ANTIHYPERTENSIVE | BAYER AKTIENGESELLSCHAFT (DT) | 1977-12-06 | — | — | US | disclosed |
| US-3950528-A | HYPOTENSIVE AGENTS, SALURETICS, DIURETICS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-04-13 | — | — | US | disclosed |