Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5516887 | 0.82 | HDAC4 (0.64) | ALDH1A1NPSR1MAPTCYP3A4CYP1A2 | |
| SCHEMBL5516107 | 0.76 | HDAC4 (0.59) | ALDH1A1MAPTCYP3A4CYP1A2KEAP1 | |
| SCHEMBL5512931 | 0.76 | SMN1; SMN2 (0.61) | ALDH1A1NPSR1MAPTKEAP1LMNA | |
| SCHEMBL5513620 | 0.74 | CA2 (0.61) | ALDH1A1NPSR1MAPTKEAP1LMNA | |
| SCHEMBL4865554 | 0.74 | NOTUM (0.68) | ALDH1A1NOTUMMAPTLMNASMN1; SMN2 | |
| SCHEMBL1272321 | 0.74 | NOTUM (0.58) | ALDH1A1NOTUMMAPTLMNAKMT2A | |
| SCHEMBL1272319 | 0.74 | NOTUM (0.58) | ALDH1A1NOTUMMAPTLMNAKMT2A | |
| SCHEMBL5510807 | 0.72 | KEAP1 (0.61) | ALDH1A1NPSR1MAPTCYP3A4CYP1A2 | |
| SCHEMBL21776935 | 0.72 | NOTUM (0.70) | ALDH1A1NOTUMMAPTCYP3A4CYP1A2 | |
| SCHEMBL91656 | 0.71 | SMN1; SMN2 (0.70) | ALDH1A1NOTUMMAPTLMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1443041-A1 | 5-AMIDINO-2-HYDROXYBENZENESULFONAMIDE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME, MEDICINAL USE THEREOF AND INTERMEDIATES IN THE PRODUCTION THEREOF | Kissei Pharmaceutical Co., Ltd. (JP) | 2004-08-04 | — | — | EP | disclosed |