Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29352216 | 0.87 | TSHR (0.65) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL2951616 | 0.87 | TSHR (0.65) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL30361992 | 0.87 | ALDH1A1 (0.55) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL1239327 | 0.87 | ALDH1A1 (0.55) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL27904278 | 0.85 | CYP1A2 (0.50) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| Lithium SCHEMBL30066819 | 0.85 | TSHR (0.62) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL22729951 | 0.83 | TSHR (0.47) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL1451563 | 0.83 | TSHR (0.60) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL6264894 | 0.82 | ALDH1A1 (0.43) | TSHRCYP1A2CYP2A6ALDH1A1MAPT | |
| SCHEMBL30066793 | 0.82 | ALDH1A1 (0.43) | TSHRCYP1A2CYP2A6ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7537844-B2 | Organometallic complexes as phosphorescent emitters in organic leds | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2009-05-26 | — | — | US | disclosed |
| US-20070296332-A1 | Organometallic complexes as phosphorescent emitters in organic LEDs | THOMPSON MARK E | 2007-12-27 | — | — | US | disclosed |