Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 2/20 | 0.31 |
| ▸ | GABRD | O14764 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL542251 | 0.91 | ALDH1A1 (0.40) | ALDH1A1BLMPMP22CHRNB2CHRNB4 | |
| SCHEMBL15657907 | 0.91 | ALDH1A1 (0.40) | ALDH1A1BLMPMP22CHRNB2CHRNB4 | |
| SCHEMBL16540946 | 0.83 | GABRP (0.45) | ALDH1A1BLMDPP4DPP8DPP9 | |
| SCHEMBL27517157 | 0.81 | SLC7A5 (0.44) | ALDH1A1ALOX15BLMPMP22KMT2A | |
| SCHEMBL16715223 | 0.81 | CYP1A2 (0.38) | ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL5189372 | 0.81 | ALDH1A1 (0.58) | ALDH1A1ALOX15TSHRGABRPGABRD | |
| SCHEMBL9619793 | 0.81 | ALDH1A1 (0.58) | ALDH1A1ALOX15TSHRGABRPGABRD | |
| SCHEMBL8572361 | 0.80 | MAPK1 (0.38) | ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL5533275 | 0.80 | ALDH1A1 (0.32) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL9236585 | 0.79 | LTA4H (0.35) | ALDH1A1ALOX15BLMPMP22KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1345332-A | C-terminally modified (N-substituted) -2-indolyl dipeptides as inhibitors of the ICE/CED-3 family of cysteine proteases | IDUN PHARMACEUTICALS INC (US) | 2002-04-17 | — | — | CN | disclosed |
| CN-1234038-A | C-terminally modified (N-substituted) -2-indolyl dipeptides as inhibitors of ICE/ced-3 class of cysteine proteases | IDUN PHARMACEUTICALS INC (US) | 1999-11-03 | — | — | CN | disclosed |
| EP-0920444-A1 | C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | Idun Pharmaceuticals, Inc. (US) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998011129-A1 | C-TERMINAL MODIFIED (N-SUBSTITUTED)-2-INDOLYL DIPEPTIDES AS INHIBITORS OF THE ICE/ced-3 FAMILY OF CYSTEINE PROTEASES | IDUN PHARMACEUTICALS, INCORPORATED (US) | 1998-03-19 | — | — | WO | disclosed |