Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12154596 | 0.82 | TAAR1 (0.46) | SIGMAR1TMEM97OPRK1ESR1ESR2 | |
| SCHEMBL6848367 | 0.82 | ACE (0.53) | MAPK1MEN1KMT2AHTTCYP1A2 | |
| SCHEMBL9630785 | 0.82 | TAAR1 (0.46) | SIGMAR1TMEM97OPRK1ESR1ESR2 | |
| SCHEMBL6852898 | 0.82 | ACE (0.53) | MAPK1MEN1KMT2AHTTCYP1A2 | |
| SCHEMBL4541734 | 0.82 | TAAR1 (0.46) | SIGMAR1TMEM97OPRK1ESR1ESR2 | |
| SCHEMBL18182128 | 0.78 | OPRK1 (0.60) | SIGMAR1TMEM97OPRK1ADRB2ESR1 | |
| SCHEMBL29084356 | 0.77 | OPRK1 (0.50) | SIGMAR1TMEM97OPRK1ADRB2ESR1 | |
| SCHEMBL20353307 | 0.74 | ESR1 (0.42) | OPRK1ADRB2ESR1ESR2ADRB1 | |
| SCHEMBL10068447 | 0.73 | ESR1 (0.48) | OPRK1ADRB2ESR1ESR2KDM4E | |
| SCHEMBL16259001 | 0.72 | TAAR1 (0.43) | SIGMAR1TMEM97OPRK1ESR1ESR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3769776-A1 | PEPTIDOMIMETIC MACROCYCLES | Aileron Therapeutics, Inc. (US) | 2021-01-27 | — | — | EP | disclosed |
| WO-2017165299-A2 | COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-09-28 | — | — | WO | disclosed |
| WO-2017004548-A1 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2017-01-05 | — | — | WO | disclosed |
| WO-2015157508-A1 | PEPTIDOMIMETIC MACROCYCLES WITH PTH ACTIVITY | AILERON THERAPEUTICS, INC. (US) | 2015-10-15 | — | — | WO | disclosed |