Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1803434 | 0.81 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL620127 | 0.78 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL9771857 | 0.78 | MAPT (0.38) | ALDH1A1L3MBTL1KMT2AMAPTLMNA | |
| SCHEMBL1123092 | 0.77 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL11048232 | 0.76 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL18802219 | 0.76 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| Tetradecane SCHEMBL9443244 | 0.76 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL3191410 | 0.76 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL17966113 | 0.76 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A | |
| SCHEMBL8579304 | 0.76 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1CYP1A2TSHRKMT2A |
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-5147512-A | Recovering 3-pentanone from a mixture with 2-pentanone using a glycol or glycol mixture extractive agent | Berg, Lloyd (US) | 1992-09-15 | — | — | US | disclosed |