Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB known ✓ | P27338 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.54 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8935413 | 0.94 | PARP10 (0.60) | PARP10MAOBADAMTS4ALDH1A1SMN1; SMN2 | |
| SCHEMBL27310687 | 0.85 | NPC1 (0.51) | PARP10MAOBALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL27344680 | 0.83 | MMP13 (0.44) | PARP10MAOBADAMTS4 | |
| SCHEMBL27322135 | 0.81 | ADAMTS4 (0.48) | ADAMTS4ALDH1A1SMN1; SMN2NPC1RAB9A | |
| Benzene SCHEMBL27309681 | 0.80 | ALDH1A1 (0.44) | PARP10ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL27309675 | 0.78 | PARP10 (0.57) | PARP10MAOBSMN1; SMN2RAB9ALMNA | |
| Hydrochloric Acid SCHEMBL27353104 | 0.77 | PARP10 (0.56) | PARP10MAOBSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL27311683 | 0.77 | PPARG (0.53) | PARP10MAOBALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL20284857 | 0.76 | FDPS (0.53) | PARP10ALDH1A1SMN1; SMN2NPC1TSHR | |
| SCHEMBL20279234 | 0.76 | FDPS (0.53) | PARP10ALDH1A1SMN1; SMN2NPC1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1027588-C | Process for the preparation of N-phenylalkyl substituted alpha-aminocarboxamide derivatives | ERBA CARLO SPA (IT) | 1995-02-08 | — | — | CN | disclosed |
| CN-1047496-A | The preparation method of the alpha-amino group Carboxylamide derivatives that N-benzene alkyl replaces | ERBA CARLO SPA (IT) | 1990-12-05 | — | — | CN | disclosed |