Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8729916 | 0.85 | TSHR (0.46) | TSHRIRAK4KDM4EHSD17B10PKM | |
| SCHEMBL32688313 | 0.83 | CRBN (0.44) | TSHRKDM4EHSD17B10DDB1CRBN | |
| SCHEMBL1713613 | 0.83 | CRBN (0.44) | TSHRKDM4EHSD17B10DDB1CRBN | |
| SCHEMBL19807935 | 0.78 | ALPI (0.40) | IRAK4KDM4EHSD17B10PKMRAB9A | |
| SCHEMBL5142126 | 0.73 | ALDH1A1 (0.47) | TSHRKDM4EHSD17B10RAB9ASMN1; SMN2 | |
| SCHEMBL1713450 | 0.73 | TSHR (0.42) | TSHRIRAK4KDM4ESMN1; SMN2DDB1 | |
| SCHEMBL13893346 | 0.70 | POLB (0.49) | TSHRTP53SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL8797169 | 0.69 | ALPI (0.41) | TSHRKDM4ESMN1; SMN2DDB1CRBN | |
| SCHEMBL14974497 | 0.68 | KDM4E (0.41) | TSHRKDM4EHSD17B10PKMNPC1 | |
| SCHEMBL31249024 | 0.68 | KDM4E (0.61) | TSHRKDM4EHSD17B10PKMNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2991990-B1 | NOVEL COMPOUNDS USEFUL AS S100-INHIBITORS | ACTIVE BIOTECH AB (SE) | 2017-02-01 | — | — | EP | disclosed |
| WO-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |