Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11306094 | 0.76 | TSHR (0.54) | TSHRNR3C1CNR2LMNAKDM4E | |
| SCHEMBL11309667 | 0.71 | TSHR (0.42) | TSHRNR3C1CNR2LMNAKDM4E | |
| SCHEMBL7805733 | 0.69 | TSHR (0.46) | TSHRNR3C1CNR2LMNAKDM4E | |
| SCHEMBL2560142 | 0.68 | TSHR (0.45) | TSHRLMNAKDM4ENPSR1POLB | |
| SCHEMBL28203798 | 0.67 | TSHR (0.81) | TSHRCNR2LMNAKDM4ECYP2C19 | |
| SCHEMBL11319896 | 0.67 | NR3C1 (0.41) | TSHRNR3C1NPSR1ALDH1A1KMT2A | |
| SCHEMBL11319163 | 0.67 | CNR2 (0.44) | TSHRNR3C1CNR2LMNACYP2C19 | |
| SCHEMBL151082 | 0.66 | TSHR (0.68) | TSHRNR3C1CNR2LMNAKDM4E | |
| SCHEMBL151565 | 0.66 | TSHR (0.57) | TSHRCNR2LMNAKDM4ENPSR1 | |
| SCHEMBL5406221 | 0.65 | TSHR (0.66) | TSHRNR3C1CNR2LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4268439-A | Basic azo dyestuffs having benzylammoniumamine substituent in the coupling component | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-19 | — | — | US | disclosed |