Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10338061 | 0.87 | TSHR (0.50) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| SCHEMBL29973162 | 0.84 | CA1 (0.50) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| SCHEMBL819594 | 0.84 | CA1 (0.50) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| Naphthalene SCHEMBL27935169 | 0.84 | TSHR (0.55) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| SCHEMBL27950969 | 0.82 | CA1 (0.60) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| Hydrogen Sulfide SCHEMBL29288364 | 0.82 | CA1 (0.48) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| Naphthalene SCHEMBL28320819 | 0.81 | TSHR (0.52) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| SCHEMBL29352197 | 0.81 | TSHR (0.63) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| SCHEMBL2818597 | 0.81 | TSHR (0.63) | ALDH1A1TSHRHSD17B10CYP1A2HPGD | |
| Water SCHEMBL19410621 | 0.81 | TSHR (0.63) | ALDH1A1TSHRHSD17B10CYP1A2HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080230715-A1 | Optical Imaging | KONINKLIJKE PHILIPS ELECTRONICS, N.V. (NL) | 2008-09-25 | — | — | US | disclosed |
| EP-1912557-A2 | OPTICAL IMAGING | Philips Intellectual Property & Standards GmbH (DE) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007015190-A2 | OPTICAL IMAGING | PHILIPS INTELLECTUAL PROPERTY & STANDARDS GMBH (DE) | 2007-02-08 | — | — | WO | disclosed |