Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27474823 | 0.86 | ALDH1A1 (0.58) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL2431836 | 0.84 | CYP1A2 (0.63) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL3003307 | 0.84 | ALDH1A1 (0.57) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL2431833 | 0.84 | CYP1A2 (0.63) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL2413159 | 0.83 | ALDH1A1 (0.55) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL29688451 | 0.83 | ALDH1A1 (0.55) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL974764 | 0.83 | ALDH1A1 (0.55) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL1305446 | 0.83 | ALDH1A1 (0.55) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL2634390 | 0.80 | ALDH1A1 (0.74) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL38657948 | 0.80 | ALDH1A1 (0.74) | CYP1A2ALDH1A1TSHRHSD17B10TDP1 |
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-6476266-B1 | Diamino compound and production process for the same | CHISSO CORPORATION (JP) | 2002-11-05 | — | — | US | disclosed |