Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Acetanilide SCHEMBL10872211 | 0.84 | NAPRT (0.83) | NAPRTHSD17B10EPHX1HTTALDH1A1 | |
| SCHEMBL4604785 | 0.83 | EPHX1 (0.87) | EPHX1HTTALDH1A1MAPTKMT2A | |
| SCHEMBL14424475 | 0.81 | EPHX1 (0.64) | EPHX1HTTALDH1A1MAPTKMT2A | |
| SCHEMBL10499696 | 0.81 | HDAC3 (0.65) | EPHX1HTTALDH1A1MAPTKMT2A | |
| Bromobenzene SCHEMBL28025843 | 0.81 | HTT (0.54) | EPHX1HTTALDH1A1CYP1A2CYP2C19 | |
| Catechol SCHEMBL27318195 | 0.81 | HTT (0.58) | HSD17B10HTTALDH1A1MAPTPOLB | |
| Acetanilide SCHEMBL28252415 | 0.80 | NAPRT (0.83) | NAPRTHSD17B10EPHX1HTTALDH1A1 | |
| Acetanilide SCHEMBL24681 | 0.80 | NAPRT (1.00) | NAPRTHSD17B10EPHX1HTTALDH1A1 | |
| SCHEMBL19669626 | 0.80 | NAPRT (1.00) | NAPRTHSD17B10EPHX1HTTALDH1A1 | |
| Acetanilide SCHEMBL1332076 | 0.80 | NAPRT (1.00) | NAPRTHSD17B10EPHX1HTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010048603-A1 | MATERIALS AND METHODS FOR SENSITIZING MULTIDRUG RESISTANT CELLS | INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) | 2010-04-29 | — | — | WO | disclosed |