Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL252240 | 0.98 | KCNH2 (0.56) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| Water SCHEMBL27458807 | 0.96 | KCNH2 (0.55) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| Hydrochloric Acid SCHEMBL2236705 | 0.96 | GAA (0.59) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| SCHEMBL3234147 | 0.86 | SIGMAR1 (0.67) | KCNH2SIGMAR1 | |
| SCHEMBL6381502 | 0.83 | KCNH2 (0.42) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| SCHEMBL11773805 | 0.80 | NPC1 (0.47) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| SCHEMBL1358088 | 0.80 | SIGMAR1 (0.59) | KCNH2SIGMAR1GAAMAPT | |
| SCHEMBL7103008 | 0.79 | SIGMAR1 (0.57) | KCNH2SIGMAR1GAAMAPTNPC1 | |
| SCHEMBL10839600 | 0.78 | SMN1; SMN2 (0.43) | NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL17626920 | 0.78 | TAAR1 (0.52) | TAAR1LMNACYP1A2CYP2D6IDO1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0843682-A1 | HIGH PURITY FORMULATIONS OF HIGHLY SUBSTITUTED LITHIUM AMIDE BASES | FMC CORPORATION (US) | 1998-05-27 | — | — | EP | disclosed |
| WO-1997006173-A1 | HIGH PURITY FORMULATIONS OF HIGHLY SUBSTITUTED LITHIUM AMIDE BASES | FMC CORPORATION (US) | 1997-02-20 | — | — | WO | disclosed |