Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LSS | P48449 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5684441 | 0.89 | PIK3CD (0.37) | KMT2AHTTMEN1PKMPOLB | |
| SCHEMBL11067142 | 0.86 | CHRNB2 (0.35) | KMT2AHTTMEN1PKMCYP1A2 | |
| SCHEMBL12780188 | 0.83 | HTT (0.41) | KMT2AHTTMEN1SMN1; SMN2TSHR | |
| SCHEMBL11809449 | 0.81 | CYP1A2 (0.39) | POLBHPGDCYP1A2CHRM2CHRM1 | |
| SCHEMBL6157129 | 0.75 | NOS3 (0.31) | — | |
| SCHEMBL412859 | 0.71 | TSHR (0.38) | KMT2AHTTMEN1POLBTSHR | |
| SCHEMBL11190672 | 0.69 | ESR2 (0.49) | CYP1A2EPHX1ALDH1A1MAPTCHRM2 | |
| SCHEMBL11199988 | 0.69 | ESR2 (0.49) | CYP1A2EPHX1ALDH1A1MAPTCHRM2 | |
| SCHEMBL11186528 | 0.69 | ESR2 (0.49) | CYP1A2EPHX1ALDH1A1MAPTCHRM2 | |
| SCHEMBL11189197 | 0.69 | ESR2 (0.49) | CYP1A2EPHX1ALDH1A1MAPTCHRM2 |
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-4434073-A | Perhydrophenanthrene derivatives, their preparation, and their use in liquid-crystalline dielectrics and electro-optical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-02-28 | — | — | US | disclosed |