Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 2/20 | 0.41 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29251765 | 0.86 | HDAC8 (0.40) | NPSR1KDM4ESMN1; SMN2ALDH1A1HPGD | |
| Toluene SCHEMBL11059058 | 0.81 | LMNA (0.41) | KDM4ESMN1; SMN2ALDH1A1HPGDLMNA | |
| Trifluoromethanesulfonic Acid SCHEMBL30330386 | 0.80 | GPR3 (0.43) | KCNH2 | |
| SCHEMBL11421745 | 0.80 | HTR1A (0.43) | NPSR1RAD52PSMD14KDM4ESMN1; SMN2 | |
| SCHEMBL9421194 | 0.80 | NPSR1 (0.39) | NPSR1RAD52PSMD14KDM4ESMN1; SMN2 | |
| SCHEMBL11483152 | 0.80 | HDAC8 (0.64) | NPSR1RAD52PSMD14KDM4ESMN1; SMN2 | |
| Trifluoromethanesulfonic Acid SCHEMBL6421880 | 0.80 | GPR3 (0.43) | KCNH2 | |
| SCHEMBL11256315 | 0.80 | NPSR1 (0.39) | NPSR1RAD52PSMD14KDM4ESMN1; SMN2 | |
| SCHEMBL9442761 | 0.80 | RAD52 (0.40) | NPSR1RAD52PSMD14KDM4ESMN1; SMN2 | |
| SCHEMBL11505821 | 0.80 | HTR1A (0.40) | NPSR1RAD52PSMD14KDM4ESMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6287458-A | — | — | None | — | — | JP | disclosed |
| EP-1056434-A1 | DYEING METHOD USING A SPECIFIC CATIONIC DERIVATIVE AND A COMPOUND SELECTED AMONG A SPECIFIC ALDEHYDE, A SPECIFIC KETONE, A QUINONE AND A DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVE | L'OREAL (FR) | 2000-12-06 | — | — | EP | disclosed |
| WO-2000038639-A1 | DYEING METHOD USING A SPECIFIC CATIONIC DERIVATIVE AND A COMPOUND SELECTED AMONG A SPECIFIC ALDEHYDE, A SPECIFIC KETONE, A QUINONE AND A DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVE | L'OREAL (FR) | 2000-07-06 | — | — | WO | disclosed |
| JP-H06287458-A | CATIONIC DYE | HODOGAYA CHEM CO LTD | 1994-10-11 | — | — | JP | disclosed |
| US-4151162-A | Diazomerocyanines and mesomeric forms thereof | L'OREAL (FR) | 1979-04-24 | — | — | US | disclosed |
| US-4025301-A | Azo dyes derived from 3-amino pyridine in hair dye compositions | SOCIETE ANONYME DITE: L'OREAL (FR) | 1977-05-24 | — | — | US | disclosed |
| US-3985499-A | Diazamerocyanines for dyeing keratinous fibers | L'OREAL (FR) | 1976-10-12 | — | — | US | disclosed |