Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6642281 | 0.84 | MAPT (0.47) | MAPTGAAALDH1A1RAB9AHSD17B10 | |
| SCHEMBL5483 | 0.81 | ALDH1A1 (0.51) | MAPTALDH1A1KMT2AKDM4EMEN1 | |
| SCHEMBL873425 | 0.80 | ALDH1A1 (0.44) | MAPTGAAALDH1A1RAB9AKMT2A | |
| SCHEMBL165885 | 0.80 | ALDH1A1 (0.49) | MAPTGAAALDH1A1L3MBTL1KMT2A | |
| SCHEMBL534242 | 0.79 | CES2 (0.52) | MAPTGAAALDH1A1L3MBTL1KMT2A | |
| SCHEMBL7638404 | 0.79 | CES2 (0.52) | MAPTGAAALDH1A1L3MBTL1KMT2A | |
| SCHEMBL7636018 | 0.79 | CES2 (0.52) | MAPTGAAALDH1A1L3MBTL1KMT2A | |
| Ethylene SCHEMBL4705578 | 0.78 | ALDH1A1 (0.49) | MAPTALDH1A1KMT2AKDM4EMEN1 | |
| SCHEMBL14993986 | 0.77 | MAPT (0.42) | MAPTGAAALDH1A1RAB9AKMT2A | |
| SCHEMBL4631018 | 0.76 | GABRP (0.43) | MAPTGAAALDH1A1L3MBTL1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112004790-A | Novel indoleamine 2, 3-dioxygenase inhibitor and preparation method and application thereof | 信达生物制药(苏州)有限公司 | 2020-11-27 | — | — | CN | disclosed |
| CN-110357813-A | A kind of new indole amine 2,3- dioxygenase inhibitor and its preparation method and application | 信达生物制药(苏州)有限公司 | 2019-10-22 | — | — | CN | disclosed |