Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.33 |
| ▸ | XDH | P47989 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.31 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8310408 | 0.88 | ALDH1A1 (0.36) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8308811 | 0.81 | CTNNB1 (0.34) | NOTUMXDHHSD17B10MAPK1NPC1 | |
| SCHEMBL8310758 | 0.81 | HSD17B10 (0.38) | ALDH1A1SMN1; SMN2TP53XDHHSD17B10 | |
| SCHEMBL8307279 | 0.79 | CYP4F2 (0.42) | ALDH1A1TSHRHSD17B10MAPK1KDM4E | |
| SCHEMBL8307724 | 0.78 | MEN1 (0.34) | ALDH1A1XDHHSD17B10MAPK1HTT | |
| SCHEMBL8310659 | 0.78 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2HSD17B10MAPK1HTT | |
| SCHEMBL9388924 | 0.76 | ALDH1A1 (0.42) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| Hydrochloric Acid SCHEMBL8308599 | 0.74 | CTNNB1 (0.33) | ALDH1A1NOTUMXDHHSD17B10MAPK1 | |
| SCHEMBL13385015 | 0.73 | SMN1; SMN2 (0.41) | ALDH1A1TSHRSMN1; SMN2TP53CASP1 | |
| SCHEMBL8310670 | 0.73 | DHODH (0.33) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0918056-A1 | Herbicides | RHONE-POULENC AGRICULTURE LTD. (GB) | 1999-05-26 | — | — | EP | disclosed |
| EP-0906279-A1 | NOVEL PYRROLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997046524-A1 | NOVEL PYRROLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-12-11 | — | — | WO | disclosed |