Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6959588 | 0.78 | KMT2A (0.61) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL31393753 | 0.76 | CHRNB2 (0.78) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL17538520 | 0.75 | POLB (0.55) | ALDH1A1L3MBTL1HTTKDM4DKDM4C | |
| SCHEMBL372 | 0.75 | KMT2A (0.60) | ALDH1A1GAAKMT2ANPC1RAB9A | |
| SCHEMBL31402608 | 0.75 | KMT2A (0.60) | ALDH1A1GAAKMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL7610390 | 0.73 | KMT2A (0.59) | ALDH1A1GAAKMT2ANPC1RAB9A | |
| SCHEMBL6970723 | 0.73 | HCAR3 (0.59) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7372972 | 0.73 | CHRNB2 (0.63) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL9318380 | 0.72 | SLC22A12 (0.55) | ALDH1A1GAAL3MBTL1KDM4DKDM4C | |
| SCHEMBL6793651 | 0.72 | NPC1 (0.63) | ALDH1A1GAACHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0620216-B1 | Benzamide derivatives and their use as vasopressin antagonists | FUJISAWA PHARMACEUTICAL CO (JP) | 2003-01-08 | — | — | EP | disclosed |
| US-5521170-A | VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-28 | — | — | US | disclosed |
| EP-0620216-A1 | Benzamide derivatives and their use as vasopressin antagonists | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-10-19 | — | — | EP | disclosed |