Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11130111 | 0.96 | TSHR (0.57) | TSHRTDP1ACHEALDH1A1MAPT | |
| SCHEMBL9750655 | 0.88 | HTR2A (0.58) | TSHRALDH1A1SIGMAR1LMNASMN1; SMN2 | |
| SCHEMBL8297797 | 0.85 | HTR2A (0.62) | TSHRALDH1A1SIGMAR1LMNASMN1; SMN2 | |
| SCHEMBL11115848 | 0.81 | SIGMAR1 (0.55) | ALDH1A1MAPTMEN1KMT2ASIGMAR1 | |
| SCHEMBL9750783 | 0.78 | ALDH1A1 (0.51) | ALDH1A1MAPTMEN1KMT2ASIGMAR1 | |
| SCHEMBL11115510 | 0.78 | ALDH1A1 (0.58) | ACHEALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL11114924 | 0.78 | SIGMAR1 (0.51) | TSHRSIGMAR1L3MBTL1HTR2AHRH1 | |
| SCHEMBL11115618 | 0.78 | HRH1 (0.50) | TSHRMAPTMEN1KMT2ASIGMAR1 | |
| SCHEMBL16039094 | 0.77 | ACHE (0.76) | TSHRACHEMAPTMEN1KMT2A | |
| SCHEMBL11113464 | 0.76 | DRD2 (0.63) | TDP1ACHEALDH1A1MAPTMEN1 |
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-0041757-B1 | ETHYLENDIAMINE DERIVATIVES, PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND INTERMEDIATES FOR THEIR PREPARATION | Simes S.p.A. (IT) | 1984-11-07 | — | — | EP | disclosed |
| EP-0041757-A1 | Ethylendiamine derivatives, preparation thereof, pharmaceutical compositions containing same and intermediates for their preparation | Simes S.p.A. (IT) | 1981-12-16 | — | — | EP | disclosed |