Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP12 | P39900 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL7425159 | 0.84 | ALDH1A1 (0.43) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL7426116 | 0.81 | RAB9A (0.52) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL7428955 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL26189857 | 0.75 | ALDH1A1 (0.68) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL7425507 | 0.74 | SRD5A2 (0.48) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL7387632 | 0.74 | RAB9A (0.49) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL29643083 | 0.73 | GABRA1 (0.49) | ALDH1A1KMT2AMAPT | |
| SCHEMBL9215592 | 0.73 | GABRA1 (0.49) | ALDH1A1KMT2AMAPT | |
| SCHEMBL7423994 | 0.73 | MMP2 (0.39) | ALDH1A1TDP1MMP2MMP9MMP12 | |
| SCHEMBL7533947 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TDP1MMP2MMP9MMP12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0946519-A1 | BENZAMIDE DERIVATIVES HAVING A VASOPRESSIN ANTAGONISTIC ACTIVITY | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998024771-A1 | BENZAMIDE DERIVATIVES HAVING A VASOPRESSIN ANTAGONISTIC ACTIVITY | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-06-11 | — | — | WO | disclosed |