Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KCNMA1 | Q12791 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11515015 | 0.92 | KCNMA1 (0.48) | ALDH1A1POLBPKMKCNMA1NPC1 | |
| SCHEMBL11593406 | 0.91 | TIMP3 (0.55) | ALDH1A1POLBPKMKCNMA1NPC1 | |
| SCHEMBL11512704 | 0.89 | KMT2A (0.57) | ALDH1A1POLBPKMKCNMA1RAB9A | |
| SCHEMBL11512365 | 0.86 | KCNMA1 (0.46) | ALDH1A1POLBKCNMA1NPC1RAB9A | |
| SCHEMBL11514490 | 0.84 | KCNMA1 (0.43) | ALDH1A1POLBKCNMA1NPC1RAB9A | |
| SCHEMBL11513848 | 0.82 | MAPT (0.53) | ALDH1A1POLBPKMNPC1RAB9A | |
| SCHEMBL11513840 | 0.82 | MAPT (0.53) | ALDH1A1POLBPKMNPC1RAB9A | |
| SCHEMBL11515000 | 0.81 | MAPT (0.45) | ALDH1A1POLBPKMNPC1RAB9A | |
| SCHEMBL10898136 | 0.80 | APEX1 (0.49) | ALDH1A1PKMMAPTTDP1KMT2A | |
| SCHEMBL11591753 | 0.79 | APEX1 (0.54) | ALDH1A1POLBPKMKCNMA1NPC1 |
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-4147801-A | UREYLENEBIS/METHYL-PHENYLENE/UREYLENE//DI-1,3,6-NAPHTHALENE TRISULFONIC ACID | AMERICAN CYANAMID COMPANY (US) | 1979-04-03 | — | — | US | disclosed |
| US-4146640-A | SULFONIC ACID AND SECONDARY AMIDE FUNCTIONAL GROUPS | AMERICAN CYANAMID COMPANY (US) | 1979-03-27 | — | — | US | disclosed |
| US-4087548-A | NAPHTHALENE TRISULFONIC ACIDS | AMERICAN CYANAMID COMPANY (US) | 1978-05-02 | — | — | US | disclosed |