Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 7/20 | 0.43 |
| ▸ | MAOA | P21397 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | AGXT | P21549 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27717162 | 0.84 | TSHR (0.42) | ALDH1A1MAOBMAOANPC1MAPT | |
| Phenol SCHEMBL11797155 | 0.81 | CA12 (0.50) | ALDH1A1MAOBMAOANPC1MAPT | |
| Diphenylether SCHEMBL28238922 | 0.81 | LTA4H (0.55) | MAOBMAOANPC1TSHR | |
| SCHEMBL28131432 | 0.79 | MAOB (0.48) | ALDH1A1MAOBMAOANPC1MAPT | |
| SCHEMBL536433 | 0.78 | MAOB (0.68) | MAOBMAOAKDM1ACYP1A2 | |
| SCHEMBL470893 | 0.76 | TSHR (0.61) | ALDH1A1NPC1IDO1AGXTTSHR | |
| SCHEMBL13259162 | 0.76 | KDM4E (0.51) | ALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL27935344 | 0.75 | KCNA3 (0.44) | ALDH1A1MAOBMAOANPC1MAPT | |
| SCHEMBL19460555 | 0.75 | TSHR (0.58) | ALDH1A1IDO1AGXTTSHR | |
| SCHEMBL39635 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-3963826-A | Low temperature, low pressure hydrogen gettering | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES ENERGY RESEARCH AND DEVELOPMENT ADMINISTRATION (US) | 1976-06-15 | — | — | US | claimed |
| EP-1265810-B8 | HYDROGEN GETTER COMPOSITION | GETTERS SPA (IT) | 2007-08-01 | — | — | EP | disclosed |
| EP-1265810-B1 | HYDROGEN GETTER COMPOSITION | GETTERS SPA (IT) | 2006-11-22 | — | — | EP | disclosed |
| US-20030052304-A1 | Hydrogen getter composition | SAES GETTERS S.P.A. | 2003-03-20 | — | — | US | disclosed |
| EP-1265810-A1 | HYDROGEN GETTER COMPOSITION | SAES GETTERS S.p.A. (IT) | 2002-12-18 | — | — | EP | disclosed |
| WO-2001068516-A1 | HYDROGEN GETTER COMPOSITION | SAES GETTERS S.P.A. (IT) | 2001-09-20 | — | — | WO | disclosed |
| US-3963826-A | Low temperature, low pressure hydrogen gettering | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES ENERGY RESEARCH AND DEVELOPMENT ADMINISTRATION (US) | 1976-06-15 | — | — | US | disclosed |