Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5620877 | 1.00 | THRA (0.42) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8930879 | 1.00 | THRA (0.42) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8902785 | 1.00 | THRA (0.42) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7879387 | 0.98 | CYP1A2 (0.44) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL27491616 | 0.98 | CYP1A2 (0.44) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8904958 | 0.98 | CYP1A2 (0.44) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL27491981 | 0.98 | CYP1A2 (0.44) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7881714 | 0.95 | L3MBTL1 (0.47) | THRATHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL27490211 | 0.93 | SMPD1 (0.45) | THRATHRBALDH1A1L3MBTL1SMPD1 | |
| SCHEMBL6226285 | 0.89 | THRA (0.41) | THRATHRBCHUKDAPK3JAK2 |
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-5648021-A | Phenanthrene derivatives and their use in liquid-crystalline mixtures | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-07-15 | — | — | US | disclosed |