Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27746838 | 0.83 | MAPT (0.43) | ALDH1A1PKMMAPTHTTTP53 | |
| SCHEMBL27767829 | 0.78 | THRB (0.42) | ALDH1A1PKMMAPTHTTMEN1 | |
| SCHEMBL28145389 | 0.72 | BACE1 (0.47) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL1150938 | 0.71 | EGFR (0.69) | MAPTTSHRDAONAPRTTP53 | |
| SCHEMBL27623409 | 0.71 | TSHR (0.39) | ALDH1A1TSHRRAB9AKDM4E | |
| Biphenyl SCHEMBL5186249 | 0.69 | EGFR (0.72) | MAPTTSHRDAONAPRTTP53 | |
| SCHEMBL7155730 | 0.69 | EGFR (0.72) | MAPTTSHRDAONAPRTTP53 | |
| SCHEMBL38562 | 0.69 | EGFR (0.72) | MAPTTSHRDAONAPRTTP53 | |
| Terephthalic Acid SCHEMBL10780545 | 0.69 | EGFR (0.72) | MAPTTSHRDAONAPRTTP53 | |
| Benzene SCHEMBL28431643 | 0.69 | EGFR (0.72) | MAPTTSHRDAONAPRTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2415771-A1 | INDOLIZINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES | Kissei Pharmaceutical Co., Ltd. (JP) | 2012-02-08 | — | — | EP | disclosed |